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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03780340

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LJ12,6-dimethyl-4-[(E)-2-phenylethenyl]phenolA,B3CN00.8
EPTHEPTANYL-P-PHENOLA,B1AHZ0.84
PTMALPHA-METHYL-O-PHOSPHOTYROSINEH,L1JYQ0.72
4594-[(1S,2S,5S,9R)-5-(HYDROXYMETHYL)-
8,9-DIMETHYL-3-OXABICYCLO[3.3.1]NON-
7-EN-2-YL]PHENOL
A,B2FAI0.73
DHB3,4-DIHYDROXYBENZOIC ACIDB2BV00.72
DHB3,4-DIHYDROXYBENZOIC ACIDA,B,D,F,H,J,L1YKP0.72
DHB3,4-DIHYDROXYBENZOIC ACIDA1N8Q0.72
DHB3,4-DIHYDROXYBENZOIC ACIDA,B2BSL0.72
DHB3,4-DIHYDROXYBENZOIC ACIDB,D,F,H,J,L1YKL0.72
DHB3,4-DIHYDROXYBENZOIC ACIDB,D1B4U0.72
DHB3,4-DIHYDROXYBENZOIC ACIDA3DX50.72
DHB3,4-DIHYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCA0.72
DHB3,4-DIHYDROXYBENZOIC ACIDB,D,F,H,J,L1YKN0.72
DHB3,4-DIHYDROXYBENZOIC ACIDB1EOB0.72
DHB3,4-DIHYDROXYBENZOIC ACIDA1PHH0.72
DHB3,4-DIHYDROXYBENZOIC ACIDB2BUV0.72
FBR(9aS)-4-bromo-9a-butyl-7-hydroxy-
1,2,9,9a-tetrahydro-3H-fluoren-
3-one
A2GIU0.77
IHB3-IODO-4-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCI0.74
G24[4-(3-BENZYL-4-HYDROXYBENZYL)-3,5-
DIMETHYLPHENOXY]ACETIC ACID
A1Q4X0.75
ADL(1,8-DIHYDROXY-9-OXO-9,10-DIHYDRO-
ANTHRACEN-2-YL)-ACETIC ACID
A,B1N5S0.75
BPYBIPHENYL-2,3-DIOLA1KMY0.78
BPYBIPHENYL-2,3-DIOLB1KW80.78
BPYBIPHENYL-2,3-DIOLA2EI30.78
BPYBIPHENYL-2,3-DIOLA1EIR0.78
BPYBIPHENYL-2,3-DIOLB1KW60.78
BPYBIPHENYL-2,3-DIOLB1KWC0.78
BPYBIPHENYL-2,3-DIOLB1KW90.78
EZT(17BETA)-17-{(E)-2-[2-(TRIFLUOROMETHYL)PHENYL]VINYL}ESTRA-
1(10),2,4-TRIENE-3,17-DIOL
A,B2P150.75
MCT4-METHYLCATECHOLA1L4G0.79
MCT4-METHYLCATECHOLA2EHZ0.79
MCT4-METHYLCATECHOLA,B1DMH0.79
NDD2,6-DICARBOXYNAPHTHALENEA1U4O0.71
NDD2,6-DICARBOXYNAPHTHALENEA,B,C,D1HAC0.71
BIK3,7-DIHYDROXY-2-NAPHTHOIC ACIDA1U5A0.76
BIK3,7-DIHYDROXY-2-NAPHTHOIC ACIDA1U5C0.76
TTB4-[(1E)-2-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRONAPHTHALEN-2-
YL)PROP-1-ENYL]BENZOIC ACID
A1XAP0.73
AEH4-(2-aminoethyl)-2-ethylphenolA3BUG0.74
5TN(2E)-3-[4-HYDROXY-3-(5,5,8,8-TETRAMETHYL-
3-PROPOXY-5,6,7,8-TETRAHYDRONAPHTHALEN-
2-YL)PHENYL]ACRYLIC ACID
A2P1V0.73
GROR-2-PHENYL-PROPRIONIC ACIDB1K5S0.75
GROR-2-PHENYL-PROPRIONIC ACIDB1KEC0.75
GROR-2-PHENYL-PROPRIONIC ACIDB1K7D0.75
OX34-HYDROXYBENZALDEHYDE O-(CYCLOHEXYLCARBONYL)OXIMEA,B,C2OOH0.76
DIN1,6-DIHYDROXY NAPHTHALENEA1ZB60.78
EED(9BETA,11ALPHA,13ALPHA,14BETA,17ALPHA)-
11-(METHOXYMETHYL)ESTRA-1(10),2,4-
TRIENE-3,17-DIOL
A,B2QGT0.75
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA3HF00.75
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA2OXK0.75
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA,B,C2OXJ0.75
BPM4-PHOSPHONOOXY-PHENYL-METHYL-[4-
PHOSPHONOOXY]BENZEN
A1AAX0.7
5PV5-PHENYLVALERIC ACIDA,B2AY90.7
IBPIBUPROFENA3FKX0.75
IBPIBUPROFENA,B2BXG0.75
IBPIBUPROFENA,B1EQG0.75
IBPIBUPROFENA,B,C2WD90.75
IBPIBUPROFENA2PWS0.75
OACTRANS-O-HYDROXY-ALPHA-METHYL CINNAMATEC3GCH0.84
3HB3-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCB0.78
3HB3-HYDROXYBENZOIC ACIDA2DKH0.78
OAL(1,8-DIHYDROXY-9,10-DIOXO-9,10-
DIHYDRO-ANTHRACEN-2-YL)-ACETIC ACID
B1N5T0.74
4TN(2E)-3-[3-(3-ETHOXY-5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRONAPHTHALEN-2-
YL)-4-HYDROXYPHENYL]ACRYLIC ACID
A2P1U0.74
EUG2-METHOXY-4-VINYL-PHENOLA2QU90.73
EUG2-METHOXY-4-VINYL-PHENOLA,B1QLU0.73
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1J0.73
EUG2-METHOXY-4-VINYL-PHENOLA,B2VAO0.73
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1K0.73
EUG2-METHOXY-4-VINYL-PHENOLA,B1DZN0.73
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1L0.73
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1M0.73
ESTESTRADIOLA,B1GWR0.78
ESTESTRADIOLA1FDS0.78
ESTESTRADIOLA,B,C1G500.78
ESTESTRADIOLA,B,C,D,E,F1ERE0.78
ESTESTRADIOLA,B1A520.78
ESTESTRADIOLA1FDT0.78
ESTESTRADIOLA2OCF0.78
ESTESTRADIOLA,B,C1QKU0.78
ESTESTRADIOLA,B,C,D,L1E6W0.78
ESTESTRADIOLA1IOL0.78
ESTESTRADIOLH1JNN0.78
ESTESTRADIOLB1QKT0.78
ESTESTRADIOLA1FDW0.78
ESTESTRADIOLA,B1AQU0.78
ESTESTRADIOLA1LHU0.78
ESTESTRADIOLA1A270.78
ESTESTRADIOLL1JGL0.78
ESTESTRADIOLA,B,E,F1PCG0.78
ESTESTRADIOLA,B,C,D1FDU0.78
ESTESTRADIOLA2J7X0.78
ESTESTRADIOLA,B2D060.78
7912-PHENYLMALONIC ACIDA1O4P0.7
PITPICEATANNOLA,B,C,D,E,F,
G,H,I,J,K,L,
M,N
2JJ10.72
DPHDEAMINO-METHYL-PHENYLALANINEA1OS00.72
DPHDEAMINO-METHYL-PHENYLALANINEA,B2JJI0.72
DPHDEAMINO-METHYL-PHENYLALANINEA,B2JJJ0.72
DPHDEAMINO-METHYL-PHENYLALANINEA,B2VS20.72
DPHDEAMINO-METHYL-PHENYLALANINEA,B1OD10.72
DPHDEAMINO-METHYL-PHENYLALANINEE1EPR0.72
FHC2-FLUORO-3-(4-HYDROXYPHENYL)-2E-
PROPENEOATE
A2OPA0.81
FHC2-FLUORO-3-(4-HYDROXYPHENYL)-2E-
PROPENEOATE
A,B,C1MFI0.81
FHC2-FLUORO-3-(4-HYDROXYPHENYL)-2E-
PROPENEOATE
A,B1GYY0.81
IPHPHENOLA,B2OLD0.7
IPHPHENOLA,B,C,D2PZV0.7
IPHPHENOLA1LI20.7
IPHPHENOLA2J9N0.7
IPHPHENOLA,B,C,D2OMB0.7
IPHPHENOLA1JHX0.7
IPHPHENOLA,B,C,D2VE70.7
IPHPHENOLB,D,E,G,H,J,L1AI00.7
IPHPHENOLA,B,C,D1FOH0.7
IPHPHENOLA1V030.7
IPHPHENOLA,C,E,G,I,K5AIY0.7
IPHPHENOLB,D,F,H,J,L1AIY0.7
IPHPHENOLA,B1XU50.7
IPHPHENOLA,B,C,D,E,G,
I,K
1W8P0.7
IPHPHENOLA,C,E,G,I,K4AIY0.7
IPHPHENOLA,B,C,D,E,F,
G,H
1XDA0.7
IPHPHENOLA2AS30.7
IPHPHENOLA,B,C,D1ZEG0.7
IPHPHENOLA,B,C,D1PN00.7
IPHPHENOLA,B,C,D1XW70.7
IPHPHENOLA,C,E,G,I,K,M1QIY0.7
IPHPHENOLA,B,C,D1Q4V0.7
IPHPHENOLB1AI70.7
IPHPHENOLA1FJW0.7
IPHPHENOLB,C,D1RWE0.7
IPHPHENOLA,B,C,D,E,G,
H,I,K
1ZNJ0.7
IPHPHENOLB,C,D3GKY0.7
IPHPHENOLA1JHY0.7
IPHPHENOLA,C,E,G,I,K3AIY0.7
IPHPHENOLA,B2OMN0.7
IPHPHENOLA,C,E,G,I,K2AIY0.7
IPHPHENOLA,B,D1MPJ0.7
IPHPHENOLA,B,C,D,F,G,
H,J
1WAV0.7
IPHPHENOLB,C,D1LPH0.7
MTYMETA-TYROSINEA2TOH0.74
MTYMETA-TYROSINEA,B1BIQ0.74
MTYMETA-TYROSINEA1Q7O0.74
2OH4,4'-PROPANE-2,2-DIYLDIPHENOLA2E2R0.83
2OH4,4'-PROPANE-2,2-DIYLDIPHENOLA2P7G0.83
34D3,5-DIHYDROXYBENZOATEA,B2BX70.72
HBAP-HYDROXYBENZALDEHYDEA1K030.72
HBAP-HYDROXYBENZALDEHYDEA,B2VQ50.72
HBAP-HYDROXYBENZALDEHYDEA,B1EB90.72
HBAP-HYDROXYBENZALDEHYDEA2GQ90.72
HBAP-HYDROXYBENZALDEHYDEA,B1Z420.72
HBAP-HYDROXYBENZALDEHYDEA1OYB0.72
2E3(2E)-3-[4-hydroxy-3-(3,5,5,8,8-
pentamethyl-5,6,7,8-tetrahydronaphthalen-
2-yl)phenyl]prop-2-enoic acid
A3FUG0.83
HPPHYDROXYPHENYL PROPIONIC ACIDA,B2TPL0.86
HPPHYDROXYPHENYL PROPIONIC ACIDA,B,C,D3GGP0.86
TYI3,5-DIIODOTYROSINEA2D8W0.7
TYI3,5-DIIODOTYROSINEE,I1CTP0.7
TYI3,5-DIIODOTYROSINEA2D970.7
TYI3,5-DIIODOTYROSINEA2AXE0.7
TYI3,5-DIIODOTYROSINEA2D8O0.7
TYI3,5-DIIODOTYROSINEA,B2VLW0.7
TYI3,5-DIIODOTYROSINEA,B2C3V0.7
TYI3,5-DIIODOTYROSINEA2D980.7
TYI3,5-DIIODOTYROSINEA2NOO0.7
TYI3,5-DIIODOTYROSINEA2D8P0.7
TYI3,5-DIIODOTYROSINEA,B,C,D,E,F,
G,H
3GH80.7
TYI3,5-DIIODOTYROSINEA,B,C,D1L0S0.7
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA1DSR0.71
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.71
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.71
IPB5-METHYL-2-(1-METHYLETHYL)PHENOLA,B1E060.84
1784-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)-
2-ISOPROPYLPHENOL
A,B1TVE0.74
YOF3-FLUOROTYROSINEA,B1XIL0.73
YOF3-FLUOROTYROSINEA,B1XDC0.73
YOF3-FLUOROTYROSINEA1RRX0.73
YOF3-FLUOROTYROSINEA,B3FYG0.73
BHQ2,5-DITERT-BUTYLBENZENE-1,4-DIOLA,B2AGV0.8
1OH4-(1-methyl-1-phenylethyl)phenolA2ZAS0.82
TY33-HYDROXY-L-TYROSINEA,B2VH30.71
SXXSINAPINATEA,B1WB40.7
TOM4-(2-METHOXYPHENYL)-2-OXOBUT-3-
ENOIC ACID
A2IMF0.72
OBPA,B2DE30.7
SDT3,4-dihydroxy-9,10-secoandrosta-
1(10),2,4-triene-9,17-dione
A,B2ZI80.78
ESLESTRIOLA1X8V0.76
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A2PIT0.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A1NQ10.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A2PIU0.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A2PKL0.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A,B3D570.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A1NQ20.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A2QPY0.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A1NQ00.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A1NUO0.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A,B2PIN0.71
AC6P-HYDROXYACETOPHENONEA2GQ80.78
AC6P-HYDROXYACETOPHENONEX2O480.78
PAC2-PHENYLACETIC ACIDB1PNL0.71
PAC2-PHENYLACETIC ACIDB1K5Q0.71
PAC2-PHENYLACETIC ACIDB1FXH0.71
PAC2-PHENYLACETIC ACIDA2ISF0.71
PAC2-PHENYLACETIC ACIDA2INE0.71
RWFR-WARFARINA,B2BXD0.7
NLANAPHTHALEN-1-YL-ACETIC ACIDA,B,C,D1LRH0.71
NLANAPHTHALEN-1-YL-ACETIC ACIDB2P1O0.71
PHBP-HYDROXYBENZOIC ACIDA1CJ40.76
PHBP-HYDROXYBENZOIC ACIDA1DOB0.76
PHBP-HYDROXYBENZOIC ACIDA1PXB0.76
PHBP-HYDROXYBENZOIC ACIDA,B1G1B0.76
PHBP-HYDROXYBENZOIC ACIDA,B1YKJ0.76
PHBP-HYDROXYBENZOIC ACIDA1IUV0.76
PHBP-HYDROXYBENZOIC ACIDA1PBE0.76
PHBP-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCC0.76
PHBP-HYDROXYBENZOIC ACIDA1PDH0.76
PHBP-HYDROXYBENZOIC ACIDB2BUW0.76
PHBP-HYDROXYBENZOIC ACIDA1CC40.76
PHBP-HYDROXYBENZOIC ACIDA1CC60.76
PHBP-HYDROXYBENZOIC ACIDA1IUW0.76
PHBP-HYDROXYBENZOIC ACIDA1FW90.76
PHBP-HYDROXYBENZOIC ACIDA1G810.76
PHBP-HYDROXYBENZOIC ACIDA1BGJ0.76
PHBP-HYDROXYBENZOIC ACIDA1IUX0.76
PHBP-HYDROXYBENZOIC ACIDA1CJ30.76
PHBP-HYDROXYBENZOIC ACIDA1D7L0.76
PHBP-HYDROXYBENZOIC ACIDA2PHH0.76
PHBP-HYDROXYBENZOIC ACIDA1BGN0.76
PHBP-HYDROXYBENZOIC ACIDA1PXA0.76
PHBP-HYDROXYBENZOIC ACIDA1DOC0.76
PHBP-HYDROXYBENZOIC ACIDA1K0I0.76
PHBP-HYDROXYBENZOIC ACIDA1BKW0.76
PHBP-HYDROXYBENZOIC ACIDA1JD30.76
PHBP-HYDROXYBENZOIC ACIDA1PXC0.76
PHBP-HYDROXYBENZOIC ACIDA1TT80.76
PHBP-HYDROXYBENZOIC ACIDA1CJ20.76
PHBP-HYDROXYBENZOIC ACIDA,B1Q4S0.76
PHBP-HYDROXYBENZOIC ACIDA1BF30.76
PHBP-HYDROXYBENZOIC ACIDB2BUR0.76
4584-[(1S,2S,5S)-5-(HYDROXYMETHYL)-
8-METHYL-3-OXABICYCLO[3.3.1]NON-
7-EN-2-YL]PHENOL
A,B2B1V0.71
ANFANTHRONEH2BJM0.75
AEG4-[(2R)-2-aminopropyl]phenolA3BUF0.71
E3O(16ALPHA,17ALPHA)-ESTRA-1,3,5(10)-
TRIENE-3,16,17-TRIOL
A2J7Y0.76
OX43-FLUORO-4-HYDROXYBENZALDEHYDE O-
(CYCLOHEXYLCARBONYL)OXIME
A,B,C2OOW0.74
DRQ(9ALPHA,13BETA,17BETA)-2-[(1Z)-
BUT-1-EN-1-YL]ESTRA-1,3,5(10)-TRIENE-
3,17-DIOL
A,B2G5O0.78
MPB4-HYDROXY-BENZOIC ACID METHYL ESTERB,C,D2VK00.74
MPB4-HYDROXY-BENZOIC ACID METHYL ESTERA,B,D3MTH0.74
LRG(2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acidA3B3K0.71
LRG(2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acidA3D6D0.71
GRR(2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acidA3CDS0.71
HC4A1TS60.84
HC4A3PHY0.84
HC4A3PYP0.84
HC4A1T1C0.84
HC4A1OT60.84
HC4A1TS00.84
HC4A1T1A0.84
HC4A2PYP0.84
HC4A2ZOI0.84
HC4A1OTI0.84
HC4A1XFQ0.84
HC4A2D010.84
HC4A,B,C,D,E,F,
G,H
2O7B0.84
HC4A2ZOH0.84
HC4A1GSW0.84
HC4A2QJ70.84
HC4A1F9I0.84
HC4X1UWP0.84
HC4A2PHY0.84
HC4A1T1B0.84
HC4A1F980.84
HC4A1T190.84
HC4X1UWN0.84
HC4A,B,C,D,E,F,
G,H
2O7F0.84
HC4A1UGU0.84
HC4A1TS80.84
HC4A,B1OTD0.84
HC4A1OTE0.84
HC4A1GSX0.84
HC4A1TS70.84
HC4A2PYR0.84
HC4A1S4S0.84
HC4A1GSV0.84
HC4A2I9V0.84
HC4A2QWS0.84
HC4A1XFN0.84
HC4A1S4R0.84
HC4A1T180.84
HC4A1OTA0.84
HC4A1D7E0.84
HC4A1S1Z0.84
HC4A,B,C1MZU0.84
HC4A,B1ODV0.84
HC4A,B2J3J0.84
HC4A2QJ50.84
HC4A1OTB0.84
HC4A2D020.84
HC4A1OT90.84
HC4A1NWZ0.84
HC4A1S1Y0.84
1963-(3-FLUORO-4-HYDROXYPHENYL)-7-
HYDROXY-1-NAPHTHONITRILE
A,B1YYE0.73
12M(2-ETHYLPHENYL)METHANOLA,B2F620.71
43M4-CHLORO-3-METHYLPHENOLA2P7A0.72
ETY4-ethylphenolA,B,C,D2RA60.82
1564-[3-OXO-3-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-
YL)-PROPENYL]-BENZOIC ACID
A1FCZ0.73
PCRP-CRESOLA1JHV0.8
PCRP-CRESOLA1JHU0.8
PCRP-CRESOLA,B,C,D1DIQ0.8
2HC(2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACIDA,B1V5Z0.81
MBD3-METHYLCATECHOLA1KNF0.77
ODEDIETHYL (1R,2S,3R,4S)-5,6-BIS(4-
HYDROXYPHENYL)-7-OXABICYCLO[2.2.1]HEPT-
5-ENE-2,3-DICARBOXYLATE
A,B2QH60.76
CLT4-PHENYL-BUTANOIC ACIDA1THL0.7
CLT4-PHENYL-BUTANOIC ACIDA,B2AY70.7
CLT4-PHENYL-BUTANOIC ACIDE,I1TMN0.7
FHB3-FLUORO-4-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCF0.74
SGI3-(4-hydroxyphenyl)propanamideA,B2R9K0.76
D1NNAPHTHALENE-1,2-DIOLA2EI10.76
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D3E5U0.75
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B3E6B0.75
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D3E5X0.75
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B2H6B0.75
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDC3E6C0.75
5554-(4-HYDROXYPHENYL)-1-NAPHTHALDEHYDE OXIMEA,B2NV70.7
DFADIPHENYLACETIC ACIDA,B,C1GMY0.71
UIN5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY-
3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN-
2-ONE
B5UPJ0.72
2LP2-ALLYLPHENOLA1OV50.79
DOB2,4-DIHYDROXYBENZOIC ACIDA1DOD0.7
DOB2,4-DIHYDROXYBENZOIC ACIDA1DOE0.7
DOB2,4-DIHYDROXYBENZOIC ACIDA1PBB0.7
PFI(6S)-6-CYCLOPENTYL-6-[2-(3-FLUORO-
4-ISOPROPOXYPHENYL)ETHYL]-4-HYDROXY-
5,6-DIHYDRO-2H-PYRAN-2-ONE
A2HAI0.72
3HP3-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCE0.83
STLRESVERATROLA,B3CKL0.76
STLRESVERATROLA,B,C,D1U0W0.76
STLRESVERATROLA1CGZ0.76
STLRESVERATROLA,B,C,D,E,F,
G,H,I,J,K,L,
M,N
2JIZ0.76
STLRESVERATROLA1Z1F0.76
STLRESVERATROLA1DVS0.76
STLRESVERATROLA,B1SG00.76
4HP4-HYDROXYPHENYLACETATEA,B,C,D2JBT0.85
4HP4-HYDROXYPHENYLACETATEA2YYJ0.85
4HP4-HYDROXYPHENYLACETATEA2YYM0.85
4HP4-HYDROXYPHENYLACETATEB1AI60.85
4HP4-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCG0.85
RMN(R)-MANDELIC ACIDA1MDL0.71
RMN(R)-MANDELIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1MCZ0.71
CIN4-CARBOXYCINNAMIC ACIDA,B,C,D1HAB0.71
CIN4-CARBOXYCINNAMIC ACIDA,B1T6J0.71
SAL2-HYDROXYBENZOIC ACIDA2I2Z0.73
SAL2-HYDROXYBENZOIC ACIDA,B,C1FIQ0.73
SAL2-HYDROXYBENZOIC ACIDA2I300.73
SAL2-HYDROXYBENZOIC ACIDA,B1PTH0.73
SAL2-HYDROXYBENZOIC ACIDA,B3DEU0.73
SAL2-HYDROXYBENZOIC ACIDA,B,C,D2E1Q0.73
SAL2-HYDROXYBENZOIC ACIDA,B3HGX0.73
SAL2-HYDROXYBENZOIC ACIDA,B3BPX0.73
SAL2-HYDROXYBENZOIC ACIDA1WYG0.73
SAL2-HYDROXYBENZOIC ACIDA1JGS0.73
SAL2-HYDROXYBENZOIC ACIDX1M6E0.73
SAL2-HYDROXYBENZOIC ACIDA3B9M0.73
SAL2-HYDROXYBENZOIC ACIDA,B1FO40.73
SAL2-HYDROXYBENZOIC ACIDA,B1Y7I0.73
SAL2-HYDROXYBENZOIC ACIDA,B2FN10.73
OHP(2-HYDROXYPHENYL)ACETIC ACIDA2INZ0.82
R129-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-
3,7-DIMETHYL-NONA-4,6,8-TRIENOIC ACID
A3CBS1
LJ33,5-dibromobiphenyl-4-olA,B3CN20.71
DHR(2S)-HYDROXY(4-HYDROXYPHENYL)ETHANENITRILEA,B1E550.72
OX1H,Y1LO20.71
TOH(3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT-
3-ENOIC ACID
A2IME0.79
TOH(3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT-
3-ENOIC ACID
A2IMD0.79
HHH(2S)-hydroxy(4-hydroxyphenyl)ethanoic acidA,B2R5V0.77
1FL5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-
BENZOIC ACID
A,B2BXE0.76
1FL5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-
BENZOIC ACID
A,B3D2T0.76
FHIA,B1Y1D0.72
PPT3-(P-TOLYL)PROPIONIC ACIDA,B2AY40.71
SWFS-WARFARINA,B1OG50.7
3CAA,B2B770.71
ECOESTRADIOL-6 CARBOXYL-METHYL-OXIMEB,D,F,H1JNH0.72
MUF(8alpha,10alpha,13alpha,17beta)-
17-[(4-hydroxyphenyl)carbonyl]androsta-
3,5-diene-3-carboxylic acid
A,B3BEJ0.75
LYL2-ALLYL-6-METHYL-PHENOLA1OV70.81
HXS4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenolA,B3CV60.86
NIU6,7,8,9-TETRAHYDRO-4-HYDROXY-3-
(1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN-
2-ONE
A6UPJ0.72
LDPL-DOPAMINEA,B2A3R0.71
LDPL-DOPAMINEA5PAH0.71
LDPL-DOPAMINEA,B2QMZ0.71
LDPL-DOPAMINEA,B2VQ50.71
17M17-METHYL-17-ALPHA-DIHYDROEQUILENINA,B2B1Z0.78
DHCCAFFEIC ACIDA,B,C,D,E,F,
G,H
2O7D0.81
DHCCAFFEIC ACIDA1KOU0.81
EQIEQUILINA,B1EQU0.82
HE74-{[(14beta,17alpha)-3-hydroxyestra-
1,3,5(10)-trien-17-yl]oxy}-4-oxobutanoic acid
A,B,C,D2Z770.81
IYR3-IODO-TYROSINEA2D980.73
IYR3-IODO-TYROSINEA2D8P0.73
IYR3-IODO-TYROSINEA,B3GFD0.73
IYR3-IODO-TYROSINEA2R1Q0.73
IYR3-IODO-TYROSINEA2ZP10.73
IYR3-IODO-TYROSINEA,B,C,D2ZXV0.73
IYR3-IODO-TYROSINEC1CF00.73
IYR3-IODO-TYROSINEA1XXZ0.73
IYR3-IODO-TYROSINEA2D970.73
IYR3-IODO-TYROSINEA1XY90.73
IYR3-IODO-TYROSINEA2Z100.73
IYR3-IODO-TYROSINEA1WQ30.73
IYR3-IODO-TYROSINEA2D8O0.73
IYR3-IODO-TYROSINEA2D8W0.73
IYR3-IODO-TYROSINEA2Z110.73
8PS5-OCTYL-2-PHENOXYPHENOLA,B,C,D,E,F2B370.72
BFLA,B1Q4G0.72
2MP3,4-DIMETHYLPHENOLA1L5O0.87
ECS2,3,17BETA-TRIHYDROXY-1,3,5(10)-
ESTRATRIENE
A,B,C,D2BW70.74
SMN(S)-MANDELIC ACIDA1MDL0.71
BPZ4,4'-cyclohexane-1,1-diyldiphenolA2ZKC0.81
4FCA1YSG0.7
TYBTYROSINALA,B1KDZ0.7
TYBTYROSINALA1Q110.7
TYBTYROSINALA,B2J5B0.7
TYBTYROSINALA,I1GA40.7
TYBTYROSINALA,B,C1NLU0.7
TYBTYROSINALA,B1KE10.7
TYBTYROSINALA,B1H3F0.7
TYBTYROSINALA,B1H3E0.7
PHTPHTHALIC ACIDA,B,C2B7P0.7
PHTPHTHALIC ACIDA3C2V0.7
PHTPHTHALIC ACIDA,B,C,D,E,F1QPR0.7
PHTPHTHALIC ACIDA,B3C2R0.7
5PP5-PENTYL-2-PHENOXYPHENOLA,B,C,D,E,F2B360.72
SDN[(3S)-9-hydroxy-1-methyl-10-oxo-
4,10-dihydro-3H-benzo[g]isochromen-
3-yl]acetic acid
A,B3B6C0.73
EYK2-tert-butylbenzene-1,4-diolD,F3EYM0.82
EYK2-tert-butylbenzene-1,4-diolB3EYK0.82
6894-[(1S,2S,5S)-5-(HYDROXYMETHYL)-
6,8,9-TRIMETHYL-3-OXABICYCLO[3.3.1]NON-
7-EN-2-YL]PHENOL
A,B1ZKY0.73
TN15,6,7,8-TETRAHYDRONAPHTHALEN-1-
OL
A1YSG0.8
DGH(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.71
DGH(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.71
EQUEQUILENINA,B1OGX0.8
EQUEQUILENINA,B,C,D,E,F1QJG0.8
EQUEQUILENINA,B1OH00.8
EQUEQUILENINA1W6Y0.8
EQUEQUILENINA,B1CQS0.8
EQUEQUILENINA1OGZ0.8
EQUEQUILENINA1GS30.8
EQUEQUILENINA1OHO0.8
PFL2,6-BIS(1-METHYLETHYL)PHENOLA,B1E7A0.84
T3O4-[(1S,2R,5S)-4,4,8-TRIMETHYL-3-
OXABICYCLO[3.3.1]NON-7-EN-2-YL]PHENOL
A,B2G440.75
4NA1-CHLORO-6-(4-HYDROXYPHENYL)-2-
NAPHTHOL
A,B1YY40.71
142CARBIDOPAA,B1JS30.71
55E4-(4-hydroxy-3-methylphenyl)-6-
phenylpyrimidin-2(5H)-one
A3DCV0.7
3TN(2E)-3-[4-HYDROXY-3-(3-METHOXY-
5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN-
2-YL)PHENYL]ACRYLIC ACID
A2P1T0.76
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A,C,E1KYZ0.74
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A1JT20.74
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A6ATJ0.74
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A,B1GKL0.74
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A1GWT0.74
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A,B,C2BJH0.74
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A1GW20.74
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A3CBG0.74
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A2BNJ0.74
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A,B1UWC0.74
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A7ATJ0.74
BYS2-BENZO[1,3]DIOXOL-5-YLMETHYL-3-
BENZYL-SUCCINIC ACID
A,B1JJE0.71
HZ3dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)-
7-oxabicyclo[2.2.1]hepta-2,5-diene-
2,3-dicarboxylate
A,B2QR90.74
1NP1-NAPHTHOLX2ZVQ0.77
JUG5-hydroxynaphthalene-1,4-dioneA,B,C,D,E,F3B7J0.73
8PP2-[(2E,6E,10E,14E,18E,22E,26E)-
3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA-
2,6,10,14,18,22,26,30-OCTAENYL]PHENOL
A,B,C,D1Y0G0.8
AI73-(heptyloxy)benzoic acidA,B2O3Z0.72
DTYD-TYROSINEA1C4B0.74
DTYD-TYROSINEA,L1ZEA0.74
DTYD-TYROSINEA,B,C,D,E,F,
G,H
1OF60.74
DTYD-TYROSINEA,B1UNO0.74
DTYD-TYROSINEA2IGZ0.74
DTYD-TYROSINEA,B,C,H,K,L2R5D0.74
DTYD-TYROSINEA,B2Q330.74
DTYD-TYROSINEH,S2H9E0.74
DTYD-TYROSINEA,B,C,H,K,L2R5B0.74
DTYD-TYROSINEA2IH00.74
DTYD-TYROSINEA1D7T0.74
DTYD-TYROSINEA,B1XA00.74
OX54-HYDROXYBENZALDEHYDE O-(3,3-DIMETHYLBUTANOYL)OXIMEA,B,C2OOZ0.79
DAH3,4-DIHYDROXYPHENYLALANINEA,B1RNR0.71
DAH3,4-DIHYDROXYPHENYLALANINEA6PAH0.71
DAH3,4-DIHYDROXYPHENYLALANINEA,B1IVV0.71
EMFethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylateA,B2QZZ0.77
EMFethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylateA,B2R2G0.77
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MRA0.76
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MNS0.76
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1DTN0.76
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MDR0.76
AEF4-(2-aminoethyl)phenolA3BRA0.72
7893-BROMO-6-HYDROXY-2-(4-HYDROXYPHENYL)-
1H-INDEN-1-ONE
A,B1ZAF0.73
HXP3,6-DIHYDROXY-XANTHENE-9-PROPIONIC ACIDA1XAN0.72
AED4-(2-aminoethyl)-2-cyclohexylphenolA3BUH0.74
DBH2,3-DIHYDROXY-BENZOIC ACIDA,B,C3CMP0.7
DBH2,3-DIHYDROXY-BENZOIC ACIDA1MD90.7
DBH2,3-DIHYDROXY-BENZOIC ACIDA1MDB0.7
DBH2,3-DIHYDROXY-BENZOIC ACIDA,B,C1L6M0.7
DBH2,3-DIHYDROXY-BENZOIC ACIDA,B,C3BY00.7
GHP4-HYDROXYPHENYLGLYCINEA1DSR0.71
DHY2-(3,4-DIHYDROXYPHENYL)ACETIC ACIDM,N,O,P,Q,R3PCN0.79
DHY2-(3,4-DIHYDROXYPHENYL)ACETIC ACIDB1AI40.79
DHY2-(3,4-DIHYDROXYPHENYL)ACETIC ACIDA,B,C,D1Q0C0.79
DHY2-(3,4-DIHYDROXYPHENYL)ACETIC ACIDA,B1F1V0.79
BP32'-CHLORO-BIPHENYL-2,3-DIOLA1LGT0.71
ESOO3-PHOSPHONOESTRONEB,C1ESS0.74
NPS(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acidA2VDB0.78
4FE(2E)-3-(3-hydroxy-4-methoxyphenyl)prop-
2-enoic acid
A3CBG0.74
CRSM-CRESOLA,B,C,D1EV30.81
CRSM-CRESOLA,B,C,D,E,F2OMG0.81
CRSM-CRESOLA,B1UZ90.81
CRSM-CRESOLA,B,C,D1ZEH0.81
CRSM-CRESOLA,B,C,D,E,F1ZEI0.81
CRSM-CRESOLA,C,D,E7INS0.81
CRSM-CRESOLA,B,C,D,E,G,
I,K
1EV60.81
ENO3-(4-HYDROXY-PHENYL)PYRUVIC ACIDH,I1A2C0.82
ENO3-(4-HYDROXY-PHENYL)PYRUVIC ACIDA,B,C1CA70.82
ENO3-(4-HYDROXY-PHENYL)PYRUVIC ACIDA,B,C,D3GGO0.82
MPP3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACIDA,B2AY30.76
ANN4-METHOXYBENZOIC ACIDA2B960.71
ANN4-METHOXYBENZOIC ACIDA2QUE0.71
ANN4-METHOXYBENZOIC ACIDA1SV30.71
ANN4-METHOXYBENZOIC ACIDA1O2E0.71
ANN4-METHOXYBENZOIC ACIDA,B,C,D3CBI0.71
DBEbis(4-hydroxyphenyl)methanoneA2VKU0.75
ETC(R,R)-5,11-CIS-DIETHYL-5,6,11,12-
TETRAHYDROCHRYSENE-2,8-DIOL
A,B1L2I0.82
ETC(R,R)-5,11-CIS-DIETHYL-5,6,11,12-
TETRAHYDROCHRYSENE-2,8-DIOL
A,B1L2J0.82
MAXMATAIRESINOLA2BGM0.75
TON2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOLA,B1SEZ0.71
1666-CARBAMIMIDOYL-2-[2-HYDROXY-6-
(4-HYDROXY-PHENYL)-INDAN-1-YL]-
HEXANOIC ACID
B,I1QJ10.71
4MA4-METHYLBENZOIC ACIDA,H2HRG0.72
DESDIETHYLSTILBESTROLA,B,C,D1S9P0.82
DESDIETHYLSTILBESTROLA,B3ERD0.82
DESDIETHYLSTILBESTROLA,B1TT60.82
DESDIETHYLSTILBESTROLA,B,C,D1TZ80.82
SN12,4-DIHYDROXY-TRANS CINNAMIC ACID11K2I0.77
OMD2-(3,6-DIHYDROXYPHENYL)ACETIC ACIDA,B1AJP0.79
SRL[2-(3,5-DI-TERT-BUTYL-4-HYDROXY-
PHENYL)-1-(DIETHOXY-PHOSPHORYL)-
VINYL]-PHOSPHONIC ACID DIETHLYL ESTER
A1ILH0.74
SRL[2-(3,5-DI-TERT-BUTYL-4-HYDROXY-
PHENYL)-1-(DIETHOXY-PHOSPHORYL)-
VINYL]-PHOSPHONIC ACID DIETHLYL ESTER
A,B1NRL0.74
FCRALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOLA,B1E0Y0.75
FCRALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOLA,B1E8G0.75
ARL7-(3,5-DITERT-BUTYLPHENYL)-3-METHYLOCTA-
2,4,6-TRIENOIC ACID
A1NQ70.72
TYCL-TYROSINAMIDEA2BF90.7
TYCL-TYROSINAMIDEA2OCI0.7
HDI3-(4-HYDROXYPHENYL)-4,5-DIHYDRO-
5-ISOXAZOLE-ACETIC ACID METHYL ESTER
A,B,C1LJT0.72
GRE2,6-DIHYDROXYBENZOIC ACIDA,B,C,D2DVU0.71
IM3(2E)-3-(3,4-DIHYDROXYPHENYL)-2-
IMINOPROPANOIC ACID
A,B,C,D2E820.75
OEF3,5-DIBROMO-4-(3-ISOPROPYL-PHENOXY)BENZOIC ACIDA2J4A0.72
OSB2-SUCCINYLBENZOATEA1FHV0.74
OSB2-SUCCINYLBENZOATEA,B,C,D1SJB0.74
OSB2-SUCCINYLBENZOATEA,B2QVH0.74
BP71,1'-BIPHENYL-3,4-DIOLA2EI00.79