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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02327641

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DHY2-(3,4-DIHYDROXYPHENYL)ACETIC ACIDM,N,O,P,Q,R3PCN0.74
DHY2-(3,4-DIHYDROXYPHENYL)ACETIC ACIDB1AI40.74
DHY2-(3,4-DIHYDROXYPHENYL)ACETIC ACIDA,B,C,D1Q0C0.74
DHY2-(3,4-DIHYDROXYPHENYL)ACETIC ACIDA,B1F1V0.74
IOL4-IODOPHENOLA,B1EWA0.83
1784-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)-
2-ISOPROPYLPHENOL
A,B1TVE0.75
SN12,4-DIHYDROXY-TRANS CINNAMIC ACID11K2I0.8
NDH(1R, 2S)-CIS 1,2 DIHYDROXY-1,2-
DIHYDRONAPHTHALENE
A,B1O7P0.73
PSYphenyl ethenesulfonateA3BM80.73
PSYphenyl ethenesulfonateA3BLT0.73
CAQCATECHOLB2BUY0.8
CAQCATECHOLA1KND0.8
CAQCATECHOLB2BUQ0.8
CAQCATECHOLA,B1DLT0.8
CAQCATECHOLA1XEP0.8
CAQCATECHOLA2PUM0.8
HXS4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenolA,B3CV60.87
1NP1-NAPHTHOLX2ZVQ0.83
2NAnaphthalen-2-ylmethanolA,B,C3EE50.7
BHQ2,5-DITERT-BUTYLBENZENE-1,4-DIOLA,B2AGV0.82
BPM4-PHOSPHONOOXY-PHENYL-METHYL-[4-
PHOSPHONOOXY]BENZEN
A1AAX0.78
IPB5-METHYL-2-(1-METHYLETHYL)PHENOLA,B1E060.89
IPHPHENOLA,B2OLD0.86
IPHPHENOLA,B,C,D2PZV0.86
IPHPHENOLA1LI20.86
IPHPHENOLA2J9N0.86
IPHPHENOLA,B,C,D2OMB0.86
IPHPHENOLA1JHX0.86
IPHPHENOLA,B,C,D2VE70.86
IPHPHENOLB,D,E,G,H,J,L1AI00.86
IPHPHENOLA,B,C,D1FOH0.86
IPHPHENOLA1V030.86
IPHPHENOLA,C,E,G,I,K5AIY0.86
IPHPHENOLB,D,F,H,J,L1AIY0.86
IPHPHENOLA,B1XU50.86
IPHPHENOLA,B,C,D,E,G,
I,K
1W8P0.86
IPHPHENOLA,C,E,G,I,K4AIY0.86
IPHPHENOLA,B,C,D,E,F,
G,H
1XDA0.86
IPHPHENOLA2AS30.86
IPHPHENOLA,B,C,D1ZEG0.86
IPHPHENOLA,B,C,D1PN00.86
IPHPHENOLA,B,C,D1XW70.86
IPHPHENOLA,C,E,G,I,K,M1QIY0.86
IPHPHENOLA,B,C,D1Q4V0.86
IPHPHENOLB1AI70.86
IPHPHENOLA1FJW0.86
IPHPHENOLB,C,D1RWE0.86
IPHPHENOLA,B,C,D,E,G,
H,I,K
1ZNJ0.86
IPHPHENOLB,C,D3GKY0.86
IPHPHENOLA1JHY0.86
IPHPHENOLA,C,E,G,I,K3AIY0.86
IPHPHENOLA,B2OMN0.86
IPHPHENOLA,C,E,G,I,K2AIY0.86
IPHPHENOLA,B,D1MPJ0.86
IPHPHENOLA,B,C,D,F,G,
H,J
1WAV0.86
IPHPHENOLB,C,D1LPH0.86
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,D1Y0G0.91
DBEbis(4-hydroxyphenyl)methanoneA2VKU0.76
IHB3-IODO-4-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCI0.73
HPSPHENYL DIHYDROGEN PHOSPHATEA1O4O0.74
OX43-FLUORO-4-HYDROXYBENZALDEHYDE O-
(CYCLOHEXYLCARBONYL)OXIME
A,B,C2OOW0.7
AEG4-[(2R)-2-aminopropyl]phenolA3BUF0.83
BP62',6'-DICHLORO-BIPHENYL-2,6-DIOLA1LKD0.72
12M(2-ETHYLPHENYL)METHANOLA,B2F620.8
BP32'-CHLORO-BIPHENYL-2,3-DIOLA1LGT0.73
HBAP-HYDROXYBENZALDEHYDEA1K030.77
HBAP-HYDROXYBENZALDEHYDEA,B2VQ50.77
HBAP-HYDROXYBENZALDEHYDEA,B1EB90.77
HBAP-HYDROXYBENZALDEHYDEA2GQ90.77
HBAP-HYDROXYBENZALDEHYDEA,B1Z420.77
HBAP-HYDROXYBENZALDEHYDEA1OYB0.77
OMD2-(3,6-DIHYDROXYPHENYL)ACETIC ACIDA,B1AJP0.74
DESDIETHYLSTILBESTROLA,B,C,D1S9P0.91
DESDIETHYLSTILBESTROLA,B3ERD0.91
DESDIETHYLSTILBESTROLA,B1TT60.91
DESDIETHYLSTILBESTROLA,B,C,D1TZ80.91
HTS2-MERCAPTOPHENOLA2OSM0.77
341(3,5-difluorophenyl)methanolC3EON0.75
3CH3-CHLOROPHENOLA1LI30.76
ANFANTHRONEH2BJM0.77
EYK2-tert-butylbenzene-1,4-diolD,F3EYM0.86
EYK2-tert-butylbenzene-1,4-diolB3EYK0.86
2BR2-BROMOPHENOLA,B,C,D2A9W0.76
FHB3-FLUORO-4-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCF0.73
PPP3-PHENYL-1,2-PROPANDIOLA,B1HRN0.73
RSOR-STYRENE OXIDEA,B1PWZ0.72
BGGCARBONIC ACID MONOBENZYL ESTERB,D1DLK0.72
OX54-HYDROXYBENZALDEHYDE O-(3,3-DIMETHYLBUTANOYL)OXIMEA,B,C2OOZ0.77
PCQ3,5,3',5'-TETRACHLORO-BIPHENYL-
4,4'-DIOL
A,B1G3M0.72
PCQ3,5,3',5'-TETRACHLORO-BIPHENYL-
4,4'-DIOL
A,B2G5U0.72
ETY4-ethylphenolA,B,C,D2RA60.99
SGI3-(4-hydroxyphenyl)propanamideA,B2R9K0.79
D1NNAPHTHALENE-1,2-DIOLA2EI10.79
TON2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOLA,B1SEZ0.72
1OH4-(1-methyl-1-phenylethyl)phenolA2ZAS0.88
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MRA0.7
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MNS0.7
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1DTN0.7
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MDR0.7
MPB4-HYDROXY-BENZOIC ACID METHYL ESTERB,C,D2VK00.74
MPB4-HYDROXY-BENZOIC ACID METHYL ESTERA,B,D3MTH0.74
2OH4,4'-PROPANE-2,2-DIYLDIPHENOLA2E2R0.87
2OH4,4'-PROPANE-2,2-DIYLDIPHENOLA2P7G0.87
DFB2,3-DIFLUOROBENZYL ALCOHOLA,B1QV70.76
DFB2,3-DIFLUOROBENZYL ALCOHOLA,B,C,D1MG00.76
OHP(2-HYDROXYPHENYL)ACETIC ACIDA2INZ0.8
RCORESORCINOLA,B,C,E,F,G,
H,I,J,K
2OLY0.79
RCORESORCINOL1,3,A,B,C,D,
E,G,H,I,K,Q,
R,S,T,U,X,Y
2OM10.79
RCORESORCINOLA,B,C,E,G,H,
I,K
2OLZ0.79
RCORESORCINOLA,B,C,D,E,F2OMH0.79
RCORESORCINOLA,B,C,E,G,H,
I,J,K
2OMI0.79
RCORESORCINOLA,B,C,D,E,G,
I,J,K
1EVR0.79
RCORESORCINOLA,C,E,G,I,K,M1QIZ0.79
RCORESORCINOL1,3,A,B,C,D,
E,G,H,I,K,Q,
R,S,U,X,Y
2OM00.79
TOM4-(2-METHOXYPHENYL)-2-OXOBUT-3-
ENOIC ACID
A2IMF0.73
FFP2,6-DIFLUOROPHENOLA2INX0.81
SS2(1R)-1-PHENYLETHANOLA1ZK00.82
SS2(1R)-1-PHENYLETHANOLA1ZJZ0.82
SS2(1R)-1-PHENYLETHANOLA1ZJY0.82
2CH2-CHLOROPHENOLA1WBO0.75
OTR4-(2R-AMINO-1-HYDROXYETHYL)PHENOLA,B1RGT0.77
OTR4-(2R-AMINO-1-HYDROXYETHYL)PHENOLA,B1RG20.77
OTR4-(2R-AMINO-1-HYDROXYETHYL)PHENOLA,B2AN40.77
3HB3-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCB0.74
3HB3-HYDROXYBENZOIC ACIDA2DKH0.74
4HP4-HYDROXYPHENYLACETATEA,B,C,D2JBT0.84
4HP4-HYDROXYPHENYLACETATEA2YYJ0.84
4HP4-HYDROXYPHENYLACETATEA2YYM0.84
4HP4-HYDROXYPHENYLACETATEB1AI60.84
4HP4-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCG0.84
SAF3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOLA1GQR0.76
SAF3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOLA1GQS0.76
4BR2-(4-METHYLPHENOXY)ETHYLPHOSPHINATEA1PE70.74
2LP2-ALLYLPHENOLA1OV50.94
HPPHYDROXYPHENYL PROPIONIC ACIDA,B2TPL0.85
HPPHYDROXYPHENYL PROPIONIC ACIDA,B,C,D3GGP0.85
MCT4-METHYLCATECHOLA1L4G0.9
MCT4-METHYLCATECHOLA2EHZ0.9
MCT4-METHYLCATECHOLA,B1DMH0.9
EZT(17BETA)-17-{(E)-2-[2-(TRIFLUOROMETHYL)PHENYL]VINYL}ESTRA-
1(10),2,4-TRIENE-3,17-DIOL
A,B2P150.72
TN15,6,7,8-TETRAHYDRONAPHTHALEN-1-
OL
A1YSG0.86
EQIEQUILINA,B1EQU0.72
PCRP-CRESOLA1JHV0.99
PCRP-CRESOLA1JHU0.99
PCRP-CRESOLA,B,C,D1DIQ0.99
BML4-BROMOPHENOLA,B,E3DHH0.76
BML4-BROMOPHENOLA,B1XU30.76
BML4-BROMOPHENOLA,B1T0S0.76
EPTHEPTANYL-P-PHENOLA,B1AHZ0.95
YOF3-FLUOROTYROSINEA,B1XIL0.7
YOF3-FLUOROTYROSINEA,B1XDC0.7
YOF3-FLUOROTYROSINEA1RRX0.7
YOF3-FLUOROTYROSINEA,B3FYG0.7
BRBPARA-BROMOBENZYL ALCOHOLA,B1HLD0.71
4594-[(1S,2S,5S,9R)-5-(HYDROXYMETHYL)-
8,9-DIMETHYL-3-OXABICYCLO[3.3.1]NON-
7-EN-2-YL]PHENOL
A,B2FAI0.72
ANN4-METHOXYBENZOIC ACIDA2B960.7
ANN4-METHOXYBENZOIC ACIDA2QUE0.7
ANN4-METHOXYBENZOIC ACIDA1SV30.7
ANN4-METHOXYBENZOIC ACIDA1O2E0.7
ANN4-METHOXYBENZOIC ACIDA,B,C,D3CBI0.7
DRQ(9ALPHA,13BETA,17BETA)-2-[(1Z)-
BUT-1-EN-1-YL]ESTRA-1,3,5(10)-TRIENE-
3,17-DIOL
A,B2G5O0.72
LNRL-NOREPINEPHRINEA,B2QEO0.71
LNRL-NOREPINEPHRINEA3DYE0.71
LNRL-NOREPINEPHRINEA4PAH0.71
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D3E5U0.73
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B3E6B0.73
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D3E5X0.73
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B2H6B0.73
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDC3E6C0.73
EED(9BETA,11ALPHA,13ALPHA,14BETA,17ALPHA)-
11-(METHOXYMETHYL)ESTRA-1(10),2,4-
TRIENE-3,17-DIOL
A,B2QGT0.72
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA3HF00.72
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA2OXK0.72
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA,B,C2OXJ0.72
LYL2-ALLYL-6-METHYL-PHENOLA1OV70.92
CRSM-CRESOLA,B,C,D1EV30.95
CRSM-CRESOLA,B,C,D,E,F2OMG0.95
CRSM-CRESOLA,B1UZ90.95
CRSM-CRESOLA,B,C,D1ZEH0.95
CRSM-CRESOLA,B,C,D,E,F1ZEI0.95
CRSM-CRESOLA,C,D,E7INS0.95
CRSM-CRESOLA,B,C,D,E,G,
I,K
1EV60.95
ESTESTRADIOLA,B1GWR0.75
ESTESTRADIOLA1FDS0.75
ESTESTRADIOLA,B,C1G500.75
ESTESTRADIOLA,B,C,D,E,F1ERE0.75
ESTESTRADIOLA,B1A520.75
ESTESTRADIOLA1FDT0.75
ESTESTRADIOLA2OCF0.75
ESTESTRADIOLA,B,C1QKU0.75
ESTESTRADIOLA,B,C,D,L1E6W0.75
ESTESTRADIOLA1IOL0.75
ESTESTRADIOLH1JNN0.75
ESTESTRADIOLB1QKT0.75
ESTESTRADIOLA1FDW0.75
ESTESTRADIOLA,B1AQU0.75
ESTESTRADIOLA1LHU0.75
ESTESTRADIOLA1A270.75
ESTESTRADIOLL1JGL0.75
ESTESTRADIOLA,B,E,F1PCG0.75
ESTESTRADIOLA,B,C,D1FDU0.75
ESTESTRADIOLA2J7X0.75
ESTESTRADIOLA,B2D060.75
HC4A1TS60.89
HC4A3PHY0.89
HC4A3PYP0.89
HC4A1T1C0.89
HC4A1OT60.89
HC4A1TS00.89
HC4A1T1A0.89
HC4A2PYP0.89
HC4A2ZOI0.89
HC4A1OTI0.89
HC4A1XFQ0.89
HC4A2D010.89
HC4A,B,C,D,E,F,
G,H
2O7B0.89
HC4A2ZOH0.89
HC4A1GSW0.89
HC4A2QJ70.89
HC4A1F9I0.89
HC4X1UWP0.89
HC4A2PHY0.89
HC4A1T1B0.89
HC4A1F980.89
HC4A1T190.89
HC4X1UWN0.89
HC4A,B,C,D,E,F,
G,H
2O7F0.89
HC4A1UGU0.89
HC4A1TS80.89
HC4A,B1OTD0.89
HC4A1OTE0.89
HC4A1GSX0.89
HC4A1TS70.89
HC4A2PYR0.89
HC4A1S4S0.89
HC4A1GSV0.89
HC4A2I9V0.89
HC4A2QWS0.89
HC4A1XFN0.89
HC4A1S4R0.89
HC4A1T180.89
HC4A1OTA0.89
HC4A1D7E0.89
HC4A1S1Z0.89
HC4A,B,C1MZU0.89
HC4A,B1ODV0.89
HC4A,B2J3J0.89
HC4A2QJ50.89
HC4A1OTB0.89
HC4A2D020.89
HC4A1OT90.89
HC4A1NWZ0.89
HC4A1S1Y0.89
FPN4-FLUOROPHENOLA,B1XVD0.83
GRE2,6-DIHYDROXYBENZOIC ACIDA,B,C,D2DVU0.7
TBP2,4,6-TRIBROMOPHENOLL1E5A0.71
OTS4-(2S-AMINO-1-HYDROXYETHYL)PHENOLA,B1RG20.77
OTS4-(2S-AMINO-1-HYDROXYETHYL)PHENOLA,B1RG10.77
OTS4-(2S-AMINO-1-HYDROXYETHYL)PHENOLA,B1RH00.77
OTS4-(2S-AMINO-1-HYDROXYETHYL)PHENOLA,B1RGU0.77
OTS4-(2S-AMINO-1-HYDROXYETHYL)PHENOLA,B1RGT0.77
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
4HC4-HYDROXY-2H-CHROMEN-2-ONEA,B1V5Y0.7
LJ12,6-dimethyl-4-[(E)-2-phenylethenyl]phenolA,B3CN00.89
DIN1,6-DIHYDROXY NAPHTHALENEA1ZB60.81
2MP3,4-DIMETHYLPHENOLA1L5O0.94
2E3(2E)-3-[4-hydroxy-3-(3,5,5,8,8-
pentamethyl-5,6,7,8-tetrahydronaphthalen-
2-yl)phenyl]prop-2-enoic acid
A3FUG0.73
TYBTYROSINALA,B1KDZ0.72
TYBTYROSINALA1Q110.72
TYBTYROSINALA,B2J5B0.72
TYBTYROSINALA,I1GA40.72
TYBTYROSINALA,B,C1NLU0.72
TYBTYROSINALA,B1KE10.72
TYBTYROSINALA,B1H3F0.72
TYBTYROSINALA,B1H3E0.72
IOB3-IODO-BENZYL ALCOHOLA,B1QK00.77
PHBP-HYDROXYBENZOIC ACIDA1CJ40.75
PHBP-HYDROXYBENZOIC ACIDA1DOB0.75
PHBP-HYDROXYBENZOIC ACIDA1PXB0.75
PHBP-HYDROXYBENZOIC ACIDA,B1G1B0.75
PHBP-HYDROXYBENZOIC ACIDA,B1YKJ0.75
PHBP-HYDROXYBENZOIC ACIDA1IUV0.75
PHBP-HYDROXYBENZOIC ACIDA1PBE0.75
PHBP-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCC0.75
PHBP-HYDROXYBENZOIC ACIDA1PDH0.75
PHBP-HYDROXYBENZOIC ACIDB2BUW0.75
PHBP-HYDROXYBENZOIC ACIDA1CC40.75
PHBP-HYDROXYBENZOIC ACIDA1CC60.75
PHBP-HYDROXYBENZOIC ACIDA1IUW0.75
PHBP-HYDROXYBENZOIC ACIDA1FW90.75
PHBP-HYDROXYBENZOIC ACIDA1G810.75
PHBP-HYDROXYBENZOIC ACIDA1BGJ0.75
PHBP-HYDROXYBENZOIC ACIDA1IUX0.75
PHBP-HYDROXYBENZOIC ACIDA1CJ30.75
PHBP-HYDROXYBENZOIC ACIDA1D7L0.75
PHBP-HYDROXYBENZOIC ACIDA2PHH0.75
PHBP-HYDROXYBENZOIC ACIDA1BGN0.75
PHBP-HYDROXYBENZOIC ACIDA1PXA0.75
PHBP-HYDROXYBENZOIC ACIDA1DOC0.75
PHBP-HYDROXYBENZOIC ACIDA1K0I0.75
PHBP-HYDROXYBENZOIC ACIDA1BKW0.75
PHBP-HYDROXYBENZOIC ACIDA1JD30.75
PHBP-HYDROXYBENZOIC ACIDA1PXC0.75
PHBP-HYDROXYBENZOIC ACIDA1TT80.75
PHBP-HYDROXYBENZOIC ACIDA1CJ20.75
PHBP-HYDROXYBENZOIC ACIDA,B1Q4S0.75
PHBP-HYDROXYBENZOIC ACIDA1BF30.75
PHBP-HYDROXYBENZOIC ACIDB2BUR0.75
1963-(3-FLUORO-4-HYDROXYPHENYL)-7-
HYDROXY-1-NAPHTHONITRILE
A,B1YYE0.71
BPYBIPHENYL-2,3-DIOLA1KMY0.81
BPYBIPHENYL-2,3-DIOLB1KW80.81
BPYBIPHENYL-2,3-DIOLA2EI30.81
BPYBIPHENYL-2,3-DIOLA1EIR0.81
BPYBIPHENYL-2,3-DIOLB1KW60.81
BPYBIPHENYL-2,3-DIOLB1KWC0.81
BPYBIPHENYL-2,3-DIOLB1KW90.81
DTYD-TYROSINEA1C4B0.72
DTYD-TYROSINEA,L1ZEA0.72
DTYD-TYROSINEA,B,C,D,E,F,
G,H
1OF60.72
DTYD-TYROSINEA,B1UNO0.72
DTYD-TYROSINEA2IGZ0.72
DTYD-TYROSINEA,B,C,H,K,L2R5D0.72
DTYD-TYROSINEA,B2Q330.72
DTYD-TYROSINEH,S2H9E0.72
DTYD-TYROSINEA,B,C,H,K,L2R5B0.72
DTYD-TYROSINEA2IH00.72
DTYD-TYROSINEA1D7T0.72
DTYD-TYROSINEA,B1XA00.72
3HP3-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCE0.78
AEH4-(2-aminoethyl)-2-ethylphenolA3BUG0.82
PFL2,6-BIS(1-METHYLETHYL)PHENOLA,B1E7A0.89
LDPL-DOPAMINEA,B2A3R0.76
LDPL-DOPAMINEA5PAH0.76
LDPL-DOPAMINEA,B2QMZ0.76
LDPL-DOPAMINEA,B2VQ50.76
NE12',3,3',4',5-PENTACHLOROBIPHENYL-
4-OL
A,B2G9K0.7
AED4-(2-aminoethyl)-2-cyclohexylphenolA3BUH0.77
269(1R)-3-chloro-1-phenylpropan-1-
ol
A2RBS0.75
ZHH2-(4-METHOXYPHENYL)ETHANAMINED,H2HKR0.73
DHCCAFFEIC ACIDA,B,C,D,E,F,
G,H
2O7D0.81
DHCCAFFEIC ACIDA1KOU0.81
OX34-HYDROXYBENZALDEHYDE O-(CYCLOHEXYLCARBONYL)OXIMEA,B,C2OOH0.72
BTTBENZENE-1,2,4,5-TETROLA,B,C,D,E,F,
G,H,I,J,K,L
1TI60.7
BTTBENZENE-1,2,4,5-TETROLM,N,O,P,Q,R,
S,T,U,V,W,X
1VLF0.7
2612-ethoxyphenolX2RB10.71
2AC2-AMINO-P-CRESOLH,I1A2C0.74
2AC2-AMINO-P-CRESOLA1L4M0.74
4584-[(1S,2S,5S)-5-(HYDROXYMETHYL)-
8-METHYL-3-OXABICYCLO[3.3.1]NON-
7-EN-2-YL]PHENOL
A,B2B1V0.74
4FA4-FLUOROPHENETHYL ALCOHOLA1OWZ0.72
MXN(2R)-hydroxy(phenyl)ethanenitrileA,B3GDN0.75
IM3(2E)-3-(3,4-DIHYDROXYPHENYL)-2-
IMINOPROPANOIC ACID
A,B,C,D2E820.7
ETC(R,R)-5,11-CIS-DIETHYL-5,6,11,12-
TETRAHYDROCHRYSENE-2,8-DIOL
A,B1L2I0.79
ETC(R,R)-5,11-CIS-DIETHYL-5,6,11,12-
TETRAHYDROCHRYSENE-2,8-DIOL
A,B1L2J0.79
NE23,3',4',5-TETRACHLOROBIPHENYL-4-
OL
A,B2GAB0.71
HFL5-(3,3-DIHYDROXYPROPENY)-3-METHOXY-
BENZENE-1,2-DIOL
C,F1KYW0.71
AEF4-(2-aminoethyl)phenolA3BRA0.85
43M4-CHLORO-3-METHYLPHENOLA2P7A0.83
DHR(2S)-HYDROXY(4-HYDROXYPHENYL)ETHANENITRILEA,B1E550.82
F165-(3-HYDROXYPHENYL)ISOTHIAZOL-3(2H)-
ONE 1,1-DIOXIDE
A2CM80.71
FHC2-FLUORO-3-(4-HYDROXYPHENYL)-2E-
PROPENEOATE
A2OPA0.86
FHC2-FLUORO-3-(4-HYDROXYPHENYL)-2E-
PROPENEOATE
A,B,C1MFI0.86
FHC2-FLUORO-3-(4-HYDROXYPHENYL)-2E-
PROPENEOATE
A,B1GYY0.86
BP71,1'-BIPHENYL-3,4-DIOLA2EI00.83
T3O4-[(1S,2R,5S)-4,4,8-TRIMETHYL-3-
OXABICYCLO[3.3.1]NON-7-EN-2-YL]PHENOL
A,B2G440.75
TOH(3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT-
3-ENOIC ACID
A2IME0.81
TOH(3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT-
3-ENOIC ACID
A2IMD0.81
W294-(3-ethylthiophen-2-yl)benzene-
1,2-diol
A3D270.71
PEL2-PHENYL-ETHANOLA,B1I0D0.75
PEL2-PHENYL-ETHANOLD,H2I0T0.75
PEL2-PHENYL-ETHANOLA,B1HZY0.75
PEL2-PHENYL-ETHANOLA,B1I0B0.75
PEL2-PHENYL-ETHANOLA1EYW0.75
PEL2-PHENYL-ETHANOLA,B1JGM0.75
PITPICEATANNOLA,B,C,D,E,F,
G,H,I,J,K,L,
M,N
2JJ10.8
TH04-MERCAPTOBENZENE-1,3-DIOLA2OSF0.71
TTO(3,4-DIHYDROXY-PHENYL)-TRIPHENYL-
ARSONIUM
A1HYZ0.73
8PS5-OCTYL-2-PHENOXYPHENOLA,B,C,D,E,F2B370.73
MBD3-METHYLCATECHOLA1KNF0.87
PYGBENZENE-1,2,3-TRIOLA,B,C,D,E,F,
G,H,I,J,K,L
1TI40.75
PYGBENZENE-1,2,3-TRIOLM,N,O,P,Q,R,
S,T,U,V,W,X
1VLE0.75
OACTRANS-O-HYDROXY-ALPHA-METHYL CINNAMATEC3GCH0.79
LJ33,5-dibromobiphenyl-4-olA,B3CN20.77
LZ25-hydroxynaphthalene-1-sulfonamideA2VTH0.7
OBPA,B2DE30.76
R129-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-
3,7-DIMETHYL-NONA-4,6,8-TRIENOIC ACID
A3CBS0.81
ECS2,3,17BETA-TRIHYDROXY-1,3,5(10)-
ESTRATRIENE
A,B,C,D2BW70.7
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
BPZ4,4'-cyclohexane-1,1-diyldiphenolA2ZKC0.83
SS11-PHENYLETHANOLH1UM50.82
3FA3-FLUOROBENZENE-1,2-DIOLA2AS40.77
TYCL-TYROSINAMIDEA2BF90.72
TYCL-TYROSINAMIDEA2OCI0.72
17M17-METHYL-17-ALPHA-DIHYDROEQUILENINA,B2B1Z0.73
24B(2,4-DIFLUOROPHENYL)METHANOLA,B1QV60.76
ENO3-(4-HYDROXY-PHENYL)PYRUVIC ACIDH,I1A2C0.8
ENO3-(4-HYDROXY-PHENYL)PYRUVIC ACIDA,B,C1CA70.8
ENO3-(4-HYDROXY-PHENYL)PYRUVIC ACIDA,B,C,D3GGO0.8
FP22-fluorophenolA3CPO0.83
AC6P-HYDROXYACETOPHENONEA2GQ80.81
AC6P-HYDROXYACETOPHENONEX2O480.81
FCRALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOLA,B1E0Y0.92
FCRALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOLA,B1E8G0.92
5PP5-PENTYL-2-PHENOXYPHENOLA,B,C,D,E,F2B360.73
SRL[2-(3,5-DI-TERT-BUTYL-4-HYDROXY-
PHENYL)-1-(DIETHOXY-PHOSPHORYL)-
VINYL]-PHOSPHONIC ACID DIETHLYL ESTER
A1ILH0.75
SRL[2-(3,5-DI-TERT-BUTYL-4-HYDROXY-
PHENYL)-1-(DIETHOXY-PHOSPHORYL)-
VINYL]-PHOSPHONIC ACID DIETHLYL ESTER
A,B1NRL0.75
6894-[(1S,2S,5S)-5-(HYDROXYMETHYL)-
6,8,9-TRIMETHYL-3-OXABICYCLO[3.3.1]NON-
7-EN-2-YL]PHENOL
A,B1ZKY0.72
4FE(2E)-3-(3-hydroxy-4-methoxyphenyl)prop-
2-enoic acid
A3CBG0.74
MNN(S)-MANDELIC ACID NITRILEA1YB60.75
MPP3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACIDA,B2AY30.71
AHT4-(2,5-DIAMINO-5-HYDROXY-PENTYL)-
PHENOL
I,T1TMB0.75
EUG2-METHOXY-4-VINYL-PHENOLA2QU90.81
EUG2-METHOXY-4-VINYL-PHENOLA,B1QLU0.81
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1J0.81
EUG2-METHOXY-4-VINYL-PHENOLA,B2VAO0.81
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1K0.81
EUG2-METHOXY-4-VINYL-PHENOLA,B1DZN0.81
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1L0.81
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1M0.81
OBZO-benzylhydroxylamineA,B3DTH0.74
OBZO-benzylhydroxylamineA,B3DTG0.74
H532-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE-
3,4,5-TRIOL
A2FF50.71
H532-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE-
3,4,5-TRIOL
A2FET0.71
2HC(2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACIDA,B1V5Z0.86
4HL4-(HYDRAZINOMETHYL)PHENOLA,B2E2U0.76
E3O(16ALPHA,17ALPHA)-ESTRA-1,3,5(10)-
TRIENE-3,16,17-TRIOL
A2J7Y0.72
HHH(2S)-hydroxy(4-hydroxyphenyl)ethanoic acidA,B2R5V0.75
PZM1-(4-METHOXYPHENYL)METHANAMINEA,D,H2HJB0.72
LJ22,6-dibromo-4-[(E)-2-phenylethenyl]phenolA,B3CN10.81
226naphthalene-1,2,4,5,7-pentolA,B2NZ50.71
IYR3-IODO-TYROSINEA2D980.7
IYR3-IODO-TYROSINEA2D8P0.7
IYR3-IODO-TYROSINEA,B3GFD0.7
IYR3-IODO-TYROSINEA2R1Q0.7
IYR3-IODO-TYROSINEA2ZP10.7
IYR3-IODO-TYROSINEA,B,C,D2ZXV0.7
IYR3-IODO-TYROSINEC1CF00.7
IYR3-IODO-TYROSINEA1XXZ0.7
IYR3-IODO-TYROSINEA2D970.7
IYR3-IODO-TYROSINEA1XY90.7
IYR3-IODO-TYROSINEA2Z100.7
IYR3-IODO-TYROSINEA1WQ30.7
IYR3-IODO-TYROSINEA2D8O0.7
IYR3-IODO-TYROSINEA2D8W0.7
IYR3-IODO-TYROSINEA2Z110.7
STLRESVERATROLA,B3CKL0.86
STLRESVERATROLA,B,C,D1U0W0.86
STLRESVERATROLA1CGZ0.86
STLRESVERATROLA,B,C,D,E,F,
G,H,I,J,K,L,
M,N
2JIZ0.86
STLRESVERATROLA1Z1F0.86
STLRESVERATROLA1DVS0.86
STLRESVERATROLA,B1SG00.86
55E4-(4-hydroxy-3-methylphenyl)-6-
phenylpyrimidin-2(5H)-one
A3DCV0.72
ESLESTRIOLA1X8V0.72