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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00009786

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AED4-(2-aminoethyl)-2-cyclohexylphenolA3BUH0.79
BP71,1'-BIPHENYL-3,4-DIOLA2EI00.85
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA3HF00.73
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA2OXK0.73
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA,B,C2OXJ0.73
CRSM-CRESOLA,B,C,D1EV30.93
CRSM-CRESOLA,B,C,D,E,F2OMG0.93
CRSM-CRESOLA,B1UZ90.93
CRSM-CRESOLA,B,C,D1ZEH0.93
CRSM-CRESOLA,B,C,D,E,F1ZEI0.93
CRSM-CRESOLA,C,D,E7INS0.93
CRSM-CRESOLA,B,C,D,E,G,
I,K
1EV60.93
OHT4-HYDROXYTAMOXIFENA3ERT0.7
OHT4-HYDROXYTAMOXIFENA,B1S9Q0.7
OHT4-HYDROXYTAMOXIFENA,B1VJB0.7
OHT4-HYDROXYTAMOXIFENA,B,C,P,R2JF90.7
OHT4-HYDROXYTAMOXIFENA,B,C,D,E,F2GPV0.7
OHT4-HYDROXYTAMOXIFENA2GPU0.7
OHT4-HYDROXYTAMOXIFENA2P7Z0.7
OHT4-HYDROXYTAMOXIFENA,B2BJ40.7
OHT4-HYDROXYTAMOXIFENA,B2FSZ0.7
JUG5-hydroxynaphthalene-1,4-dioneA,B,C,D,E,F3B7J0.71
12M(2-ETHYLPHENYL)METHANOLA,B2F620.83
PCQ3,5,3',5'-TETRACHLORO-BIPHENYL-
4,4'-DIOL
A,B1G3M0.74
PCQ3,5,3',5'-TETRACHLORO-BIPHENYL-
4,4'-DIOL
A,B2G5U0.74
RSOR-STYRENE OXIDEA,B1PWZ0.74
TRTFRAGMENT OF TRITON X-100A,E2I0U0.72
TRTFRAGMENT OF TRITON X-100A,B1OIZ0.72
FPN4-FLUOROPHENOLA,B1XVD0.81
AEH4-(2-aminoethyl)-2-ethylphenolA3BUG0.84
TTO(3,4-DIHYDROXY-PHENYL)-TRIPHENYL-
ARSONIUM
A1HYZ0.71
TON2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOLA,B1SEZ0.74
1OH4-(1-methyl-1-phenylethyl)phenolA2ZAS0.9
LDPL-DOPAMINEA,B2A3R0.78
LDPL-DOPAMINEA5PAH0.78
LDPL-DOPAMINEA,B2QMZ0.78
LDPL-DOPAMINEA,B2VQ50.78
EQIEQUILINA,B1EQU0.74
EZT(17BETA)-17-{(E)-2-[2-(TRIFLUOROMETHYL)PHENYL]VINYL}ESTRA-
1(10),2,4-TRIENE-3,17-DIOL
A,B2P150.74
4594-[(1S,2S,5S,9R)-5-(HYDROXYMETHYL)-
8,9-DIMETHYL-3-OXABICYCLO[3.3.1]NON-
7-EN-2-YL]PHENOL
A,B2FAI0.74
IHB3-IODO-4-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCI0.73
2NAnaphthalen-2-ylmethanolA,B,C3EE50.72
MCT4-METHYLCATECHOLA1L4G0.88
MCT4-METHYLCATECHOLA2EHZ0.88
MCT4-METHYLCATECHOLA,B1DMH0.88
226naphthalene-1,2,4,5,7-pentolA,B2NZ50.73
EED(9BETA,11ALPHA,13ALPHA,14BETA,17ALPHA)-
11-(METHOXYMETHYL)ESTRA-1(10),2,4-
TRIENE-3,17-DIOL
A,B2QGT0.74
4HP4-HYDROXYPHENYLACETATEA,B,C,D2JBT0.86
4HP4-HYDROXYPHENYLACETATEA2YYJ0.86
4HP4-HYDROXYPHENYLACETATEA2YYM0.86
4HP4-HYDROXYPHENYLACETATEB1AI60.86
4HP4-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCG0.86
BP32'-CHLORO-BIPHENYL-2,3-DIOLA1LGT0.75
DRQ(9ALPHA,13BETA,17BETA)-2-[(1Z)-
BUT-1-EN-1-YL]ESTRA-1,3,5(10)-TRIENE-
3,17-DIOL
A,B2G5O0.74
SMN(S)-MANDELIC ACIDA1MDL0.7
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
ZZ14-METHYL-2H-CHROMEN-2-ONEA2CIP0.71
341(3,5-difluorophenyl)methanolC3EON0.75
OX54-HYDROXYBENZALDEHYDE O-(3,3-DIMETHYLBUTANOYL)OXIMEA,B,C2OOZ0.75
DHR(2S)-HYDROXY(4-HYDROXYPHENYL)ETHANENITRILEA,B1E550.84
H532-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE-
3,4,5-TRIOL
A2FF50.73
H532-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE-
3,4,5-TRIOL
A2FET0.73
4HL4-(HYDRAZINOMETHYL)PHENOLA,B2E2U0.75
HBAP-HYDROXYBENZALDEHYDEA1K030.75
HBAP-HYDROXYBENZALDEHYDEA,B2VQ50.75
HBAP-HYDROXYBENZALDEHYDEA,B1EB90.75
HBAP-HYDROXYBENZALDEHYDEA2GQ90.75
HBAP-HYDROXYBENZALDEHYDEA,B1Z420.75
HBAP-HYDROXYBENZALDEHYDEA1OYB0.75
2CH2-CHLOROPHENOLA1WBO0.73
3HP3-HYDROXYPHENYLACETATEM,N,O,P,Q,R3PCE0.8
OBPA,B2DE30.78
SDT3,4-dihydroxy-9,10-secoandrosta-
1(10),2,4-triene-9,17-dione
A,B2ZI80.7
FHB3-FLUORO-4-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCF0.73
G503-(4-HYDROXYPHENYL)-1-(2,4,6-TRIHYDROXYPHENYL)PROPAN-
1-ONE
A,B2UXI0.71
SN12,4-DIHYDROXY-TRANS CINNAMIC ACID11K2I0.81
BGGCARBONIC ACID MONOBENZYL ESTERB,D1DLK0.72
ETY4-ethylphenolA,B,C,D2RA60.99
4584-[(1S,2S,5S)-5-(HYDROXYMETHYL)-
8-METHYL-3-OXABICYCLO[3.3.1]NON-
7-EN-2-YL]PHENOL
A,B2B1V0.76
MPB4-HYDROXY-BENZOIC ACID METHYL ESTERB,C,D2VK00.74
MPB4-HYDROXY-BENZOIC ACID METHYL ESTERA,B,D3MTH0.74
IPHPHENOLA,B2OLD0.84
IPHPHENOLA,B,C,D2PZV0.84
IPHPHENOLA1LI20.84
IPHPHENOLA2J9N0.84
IPHPHENOLA,B,C,D2OMB0.84
IPHPHENOLA1JHX0.84
IPHPHENOLA,B,C,D2VE70.84
IPHPHENOLB,D,E,G,H,J,L1AI00.84
IPHPHENOLA,B,C,D1FOH0.84
IPHPHENOLA1V030.84
IPHPHENOLA,C,E,G,I,K5AIY0.84
IPHPHENOLB,D,F,H,J,L1AIY0.84
IPHPHENOLA,B1XU50.84
IPHPHENOLA,B,C,D,E,G,
I,K
1W8P0.84
IPHPHENOLA,C,E,G,I,K4AIY0.84
IPHPHENOLA,B,C,D,E,F,
G,H
1XDA0.84
IPHPHENOLA2AS30.84
IPHPHENOLA,B,C,D1ZEG0.84
IPHPHENOLA,B,C,D1PN00.84
IPHPHENOLA,B,C,D1XW70.84
IPHPHENOLA,C,E,G,I,K,M1QIY0.84
IPHPHENOLA,B,C,D1Q4V0.84
IPHPHENOLB1AI70.84
IPHPHENOLA1FJW0.84
IPHPHENOLB,C,D1RWE0.84
IPHPHENOLA,B,C,D,E,G,
H,I,K
1ZNJ0.84
IPHPHENOLB,C,D3GKY0.84
IPHPHENOLA1JHY0.84
IPHPHENOLA,C,E,G,I,K3AIY0.84
IPHPHENOLA,B2OMN0.84
IPHPHENOLA,C,E,G,I,K2AIY0.84
IPHPHENOLA,B,D1MPJ0.84
IPHPHENOLA,B,C,D,F,G,
H,J
1WAV0.84
IPHPHENOLB,C,D1LPH0.84
DFB2,3-DIFLUOROBENZYL ALCOHOLA,B1QV70.76
DFB2,3-DIFLUOROBENZYL ALCOHOLA,B,C,D1MG00.76
TOM4-(2-METHOXYPHENYL)-2-OXOBUT-3-
ENOIC ACID
A2IMF0.73
LJ33,5-dibromobiphenyl-4-olA,B3CN20.79
MPP3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACIDA,B2AY30.72
1963-(3-FLUORO-4-HYDROXYPHENYL)-7-
HYDROXY-1-NAPHTHONITRILE
A,B1YYE0.73
YOF3-FLUOROTYROSINEA,B1XIL0.72
YOF3-FLUOROTYROSINEA,B1XDC0.72
YOF3-FLUOROTYROSINEA1RRX0.72
YOF3-FLUOROTYROSINEA,B3FYG0.72
PPP3-PHENYL-1,2-PROPANDIOLA,B1HRN0.75
FFP2,6-DIFLUOROPHENOLA2INX0.79
BRBPARA-BROMOBENZYL ALCOHOLA,B1HLD0.71
NE23,3',4',5-TETRACHLOROBIPHENYL-4-
OL
A,B2GAB0.73
3HB3-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCB0.75
3HB3-HYDROXYBENZOIC ACIDA2DKH0.75
IPB5-METHYL-2-(1-METHYLETHYL)PHENOLA,B1E060.91
DESDIETHYLSTILBESTROLA,B,C,D1S9P0.93
DESDIETHYLSTILBESTROLA,B3ERD0.93
DESDIETHYLSTILBESTROLA,B1TT60.93
DESDIETHYLSTILBESTROLA,B,C,D1TZ80.93
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MRA0.72
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MNS0.72
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1DTN0.72
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MDR0.72
BP62',6'-DICHLORO-BIPHENYL-2,6-DIOLA1LKD0.74
EQUEQUILENINA,B1OGX0.7
EQUEQUILENINA,B,C,D,E,F1QJG0.7
EQUEQUILENINA,B1OH00.7
EQUEQUILENINA1W6Y0.7
EQUEQUILENINA,B1CQS0.7
EQUEQUILENINA1OGZ0.7
EQUEQUILENINA1GS30.7
EQUEQUILENINA1OHO0.7
HPSPHENYL DIHYDROGEN PHOSPHATEA1O4O0.72
SS11-PHENYLETHANOLH1UM50.85
W294-(3-ethylthiophen-2-yl)benzene-
1,2-diol
A3D270.73
EPTHEPTANYL-P-PHENOLA,B1AHZ0.98
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
T3O4-[(1S,2R,5S)-4,4,8-TRIMETHYL-3-
OXABICYCLO[3.3.1]NON-7-EN-2-YL]PHENOL
A,B2G440.76
BPZ4,4'-cyclohexane-1,1-diyldiphenolA2ZKC0.85
3FA3-FLUOROBENZENE-1,2-DIOLA2AS40.76
4BR2-(4-METHYLPHENOXY)ETHYLPHOSPHINATEA1PE70.73
D1NNAPHTHALENE-1,2-DIOLA2EI10.81
1784-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)-
2-ISOPROPYLPHENOL
A,B1TVE0.77
GRE2,6-DIHYDROXYBENZOIC ACIDA,B,C,D2DVU0.7
SGI3-(4-hydroxyphenyl)propanamideA,B2R9K0.81
HCC2',4,4'-TRIHYDROXYCHALCONED1FP10.71
IOL4-IODOPHENOLA,B1EWA0.81
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
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,D1Y0G0.93
OHP(2-HYDROXYPHENYL)ACETIC ACIDA2INZ0.82
4HC4-HYDROXY-2H-CHROMEN-2-ONEA,B1V5Y0.7
LJ12,6-dimethyl-4-[(E)-2-phenylethenyl]phenolA,B3CN00.89
OXNOXTOXYNOL-10A1IKT0.71
OXNOXTOXYNOL-10A,B2Q320.71
OXNOXTOXYNOL-10A,B1UEH0.71
OXNOXTOXYNOL-10A,B2D4Q0.71
2MP3,4-DIMETHYLPHENOLA1L5O0.94
HHH(2S)-hydroxy(4-hydroxyphenyl)ethanoic acidA,B2R5V0.77
IM3(2E)-3-(3,4-DIHYDROXYPHENYL)-2-
IMINOPROPANOIC ACID
A,B,C,D2E820.72
HTS2-MERCAPTOPHENOLA2OSM0.76
ZHH2-(4-METHOXYPHENYL)ETHANAMINED,H2HKR0.74
2BR2-BROMOPHENOLA,B,C,D2A9W0.75
IOB3-IODO-BENZYL ALCOHOLA,B1QK00.77
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A,C,E1KYZ0.72
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A1JT20.72
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A6ATJ0.72
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A,B1GKL0.72
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A1GWT0.72
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A,B,C2BJH0.72
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A1GW20.72
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A3CBG0.72
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A2BNJ0.72
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A,B1UWC0.72
FER3-(4-HYDROXY-3-METHOXYPHENYL)-2-
PROPENOIC ACID
A7ATJ0.72
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
TYCL-TYROSINAMIDEA2BF90.74
TYCL-TYROSINAMIDEA2OCI0.74
STLRESVERATROLA,B3CKL0.84
STLRESVERATROLA,B,C,D1U0W0.84
STLRESVERATROLA1CGZ0.84
STLRESVERATROLA,B,C,D,E,F,
G,H,I,J,K,L,
M,N
2JIZ0.84
STLRESVERATROLA1Z1F0.84
STLRESVERATROLA1DVS0.84
STLRESVERATROLA,B1SG00.84
ETC(R,R)-5,11-CIS-DIETHYL-5,6,11,12-
TETRAHYDROCHRYSENE-2,8-DIOL
A,B1L2I0.81
ETC(R,R)-5,11-CIS-DIETHYL-5,6,11,12-
TETRAHYDROCHRYSENE-2,8-DIOL
A,B1L2J0.81
MNN(S)-MANDELIC ACID NITRILEA1YB60.77
AEG4-[(2R)-2-aminopropyl]phenolA3BUF0.85
BHQ2,5-DITERT-BUTYLBENZENE-1,4-DIOLA,B2AGV0.84
DR6ALPHA-[4-(1,1,3,3 - TETRAMETHYLBUTYL)PHENYL]-
OMEGA-HYDROXY-POLY(OXY-1,2-ETHANEDIYL)
C,I,T1YTZ0.7
2OH4,4'-PROPANE-2,2-DIYLDIPHENOLA2E2R0.89
2OH4,4'-PROPANE-2,2-DIYLDIPHENOLA2P7G0.89
6894-[(1S,2S,5S)-5-(HYDROXYMETHYL)-
6,8,9-TRIMETHYL-3-OXABICYCLO[3.3.1]NON-
7-EN-2-YL]PHENOL
A,B1ZKY0.74
2E3(2E)-3-[4-hydroxy-3-(3,5,5,8,8-
pentamethyl-5,6,7,8-tetrahydronaphthalen-
2-yl)phenyl]prop-2-enoic acid
A3FUG0.75
AHT4-(2,5-DIAMINO-5-HYDROXY-PENTYL)-
PHENOL
I,T1TMB0.77
4FE(2E)-3-(3-hydroxy-4-methoxyphenyl)prop-
2-enoic acid
A3CBG0.72
ANFANTHRONEH2BJM0.79
DBEbis(4-hydroxyphenyl)methanoneA2VKU0.78
ESTESTRADIOLA,B1GWR0.76
ESTESTRADIOLA1FDS0.76
ESTESTRADIOLA,B,C1G500.76
ESTESTRADIOLA,B,C,D,E,F1ERE0.76
ESTESTRADIOLA,B1A520.76
ESTESTRADIOLA1FDT0.76
ESTESTRADIOLA2OCF0.76
ESTESTRADIOLA,B,C1QKU0.76
ESTESTRADIOLA,B,C,D,L1E6W0.76
ESTESTRADIOLA1IOL0.76
ESTESTRADIOLH1JNN0.76
ESTESTRADIOLB1QKT0.76
ESTESTRADIOLA1FDW0.76
ESTESTRADIOLA,B1AQU0.76
ESTESTRADIOLA1LHU0.76
ESTESTRADIOLA1A270.76
ESTESTRADIOLL1JGL0.76
ESTESTRADIOLA,B,E,F1PCG0.76
ESTESTRADIOLA,B,C,D1FDU0.76
ESTESTRADIOLA2J7X0.76
ESTESTRADIOLA,B2D060.76
NE12',3,3',4',5-PENTACHLOROBIPHENYL-
4-OL
A,B2G9K0.72
4MU7-hydroxy-4-methyl-2H-chromen-2-
one
A,B3ETS0.72
FP22-fluorophenolA3CPO0.81
R129-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-
3,7-DIMETHYL-NONA-4,6,8-TRIENOIC ACID
A3CBS0.82
HPPHYDROXYPHENYL PROPIONIC ACIDA,B2TPL0.87
HPPHYDROXYPHENYL PROPIONIC ACIDA,B,C,D3GGP0.87
OX34-HYDROXYBENZALDEHYDE O-(CYCLOHEXYLCARBONYL)OXIMEA,B,C2OOH0.72
OX43-FLUORO-4-HYDROXYBENZALDEHYDE O-
(CYCLOHEXYLCARBONYL)OXIME
A,B,C2OOW0.71
BML4-BROMOPHENOLA,B,E3DHH0.75
BML4-BROMOPHENOLA,B1XU30.75
BML4-BROMOPHENOLA,B1T0S0.75
SRL[2-(3,5-DI-TERT-BUTYL-4-HYDROXY-
PHENYL)-1-(DIETHOXY-PHOSPHORYL)-
VINYL]-PHOSPHONIC ACID DIETHLYL ESTER
A1ILH0.77
SRL[2-(3,5-DI-TERT-BUTYL-4-HYDROXY-
PHENYL)-1-(DIETHOXY-PHOSPHORYL)-
VINYL]-PHOSPHONIC ACID DIETHLYL ESTER
A,B1NRL0.77
1NP1-NAPHTHOLX2ZVQ0.85
E3O(16ALPHA,17ALPHA)-ESTRA-1,3,5(10)-
TRIENE-3,16,17-TRIOL
A2J7Y0.74
2LP2-ALLYLPHENOLA1OV50.96
PITPICEATANNOLA,B,C,D,E,F,
G,H,I,J,K,L,
M,N
2JJ10.79
FBR(9aS)-4-bromo-9a-butyl-7-hydroxy-
1,2,9,9a-tetrahydro-3H-fluoren-
3-one
A2GIU0.71
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
HC4A1TS60.87
HC4A3PHY0.87
HC4A3PYP0.87
HC4A1T1C0.87
HC4A1OT60.87
HC4A1TS00.87
HC4A1T1A0.87
HC4A2PYP0.87
HC4A2ZOI0.87
HC4A1OTI0.87
HC4A1XFQ0.87
HC4A2D010.87
HC4A,B,C,D,E,F,
G,H
2O7B0.87
HC4A2ZOH0.87
HC4A1GSW0.87
HC4A2QJ70.87
HC4A1F9I0.87
HC4X1UWP0.87
HC4A2PHY0.87
HC4A1T1B0.87
HC4A1F980.87
HC4A1T190.87
HC4X1UWN0.87
HC4A,B,C,D,E,F,
G,H
2O7F0.87
HC4A1UGU0.87
HC4A1TS80.87
HC4A,B1OTD0.87
HC4A1OTE0.87
HC4A1GSX0.87
HC4A1TS70.87
HC4A2PYR0.87
HC4A1S4S0.87
HC4A1GSV0.87
HC4A2I9V0.87
HC4A2QWS0.87
HC4A1XFN0.87
HC4A1S4R0.87
HC4A1T180.87
HC4A1OTA0.87
HC4A1D7E0.87
HC4A1S1Z0.87
HC4A,B,C1MZU0.87
HC4A,B1ODV0.87
HC4A,B2J3J0.87
HC4A2QJ50.87
HC4A1OTB0.87
HC4A2D020.87
HC4A1OT90.87
HC4A1NWZ0.87
HC4A1S1Y0.87
LNRL-NOREPINEPHRINEA,B2QEO0.73
LNRL-NOREPINEPHRINEA3DYE0.73
LNRL-NOREPINEPHRINEA4PAH0.73
AEF4-(2-aminoethyl)phenolA3BRA0.85
55E4-(4-hydroxy-3-methylphenyl)-6-
phenylpyrimidin-2(5H)-one
A3DCV0.74
ESLESTRIOLA1X8V0.74
AC6P-HYDROXYACETOPHENONEA2GQ80.82
AC6P-HYDROXYACETOPHENONEX2O480.82
LYL2-ALLYL-6-METHYL-PHENOLA1OV70.94
TOH(3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT-
3-ENOIC ACID
A2IME0.81
TOH(3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT-
3-ENOIC ACID
A2IMD0.81
4NA1-CHLORO-6-(4-HYDROXYPHENYL)-2-
NAPHTHOL
A,B1YY40.71
4FA4-FLUOROPHENETHYL ALCOHOLA1OWZ0.75
IYR3-IODO-TYROSINEA2D980.72
IYR3-IODO-TYROSINEA2D8P0.72
IYR3-IODO-TYROSINEA,B3GFD0.72
IYR3-IODO-TYROSINEA2R1Q0.72
IYR3-IODO-TYROSINEA2ZP10.72
IYR3-IODO-TYROSINEA,B,C,D2ZXV0.72
IYR3-IODO-TYROSINEC1CF00.72
IYR3-IODO-TYROSINEA1XXZ0.72
IYR3-IODO-TYROSINEA2D970.72
IYR3-IODO-TYROSINEA1XY90.72
IYR3-IODO-TYROSINEA2Z100.72
IYR3-IODO-TYROSINEA1WQ30.72
IYR3-IODO-TYROSINEA2D8O0.72
IYR3-IODO-TYROSINEA2D8W0.72
IYR3-IODO-TYROSINEA2Z110.72
MXN(2R)-hydroxy(phenyl)ethanenitrileA,B3GDN0.77
LJ22,6-dibromo-4-[(E)-2-phenylethenyl]phenolA,B3CN10.79
MBD3-METHYLCATECHOLA1KNF0.87
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A2PIT0.7
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A1NQ10.7
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A2PIU0.7
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A2PKL0.7
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A,B3D570.7
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A1NQ20.7
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A2QPY0.7
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A1NQ00.7
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A1NUO0.7
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A,B2PIN0.7
5PP5-PENTYL-2-PHENOXYPHENOLA,B,C,D,E,F2B360.75
OTR4-(2R-AMINO-1-HYDROXYETHYL)PHENOLA,B1RGT0.79
OTR4-(2R-AMINO-1-HYDROXYETHYL)PHENOLA,B1RG20.79
OTR4-(2R-AMINO-1-HYDROXYETHYL)PHENOLA,B2AN40.79
HXS4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenolA,B3CV60.89
43M4-CHLORO-3-METHYLPHENOLA2P7A0.81
FHC2-FLUORO-3-(4-HYDROXYPHENYL)-2E-
PROPENEOATE
A2OPA0.84
FHC2-FLUORO-3-(4-HYDROXYPHENYL)-2E-
PROPENEOATE
A,B,C1MFI0.84
FHC2-FLUORO-3-(4-HYDROXYPHENYL)-2E-
PROPENEOATE
A,B1GYY0.84
RCORESORCINOLA,B,C,E,F,G,
H,I,J,K
2OLY0.77
RCORESORCINOL1,3,A,B,C,D,
E,G,H,I,K,Q,
R,S,T,U,X,Y
2OM10.77
RCORESORCINOLA,B,C,E,G,H,
I,K
2OLZ0.77
RCORESORCINOLA,B,C,D,E,F2OMH0.77
RCORESORCINOLA,B,C,E,G,H,
I,J,K
2OMI0.77
RCORESORCINOLA,B,C,D,E,G,
I,J,K
1EVR0.77
RCORESORCINOLA,C,E,G,I,K,M1QIZ0.77
RCORESORCINOL1,3,A,B,C,D,
E,G,H,I,K,Q,
R,S,U,X,Y
2OM00.77
TYBTYROSINALA,B1KDZ0.74
TYBTYROSINALA1Q110.74
TYBTYROSINALA,B2J5B0.74
TYBTYROSINALA,I1GA40.74
TYBTYROSINALA,B,C1NLU0.74
TYBTYROSINALA,B1KE10.74
TYBTYROSINALA,B1H3F0.74
TYBTYROSINALA,B1H3E0.74
PEL2-PHENYL-ETHANOLA,B1I0D0.77
PEL2-PHENYL-ETHANOLD,H2I0T0.77
PEL2-PHENYL-ETHANOLA,B1HZY0.77
PEL2-PHENYL-ETHANOLA,B1I0B0.77
PEL2-PHENYL-ETHANOLA1EYW0.77
PEL2-PHENYL-ETHANOLA,B1JGM0.77
PZM1-(4-METHOXYPHENYL)METHANAMINEA,D,H2HJB0.7
OMD2-(3,6-DIHYDROXYPHENYL)ACETIC ACIDA,B1AJP0.76
BPM4-PHOSPHONOOXY-PHENYL-METHYL-[4-
PHOSPHONOOXY]BENZEN
A1AAX0.8
24B(2,4-DIFLUOROPHENYL)METHANOLA,B1QV60.76
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
PCRP-CRESOLA1JHV0.96
PCRP-CRESOLA1JHU0.96
PCRP-CRESOLA,B,C,D1DIQ0.96
MTYMETA-TYROSINEA2TOH0.71
MTYMETA-TYROSINEA,B1BIQ0.71
MTYMETA-TYROSINEA1Q7O0.71
17M17-METHYL-17-ALPHA-DIHYDROEQUILENINA,B2B1Z0.75
4MA4-METHYLBENZOIC ACIDA,H2HRG0.7
EUG2-METHOXY-4-VINYL-PHENOLA2QU90.79
EUG2-METHOXY-4-VINYL-PHENOLA,B1QLU0.79
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1J0.79
EUG2-METHOXY-4-VINYL-PHENOLA,B2VAO0.79
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1K0.79
EUG2-METHOXY-4-VINYL-PHENOLA,B1DZN0.79
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1L0.79
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1M0.79
PSYphenyl ethenesulfonateA3BM80.71
PSYphenyl ethenesulfonateA3BLT0.71
8PS5-OCTYL-2-PHENOXYPHENOLA,B,C,D,E,F2B370.75
SAF3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOLA1GQR0.78
SAF3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOLA1GQS0.78
NDH(1R, 2S)-CIS 1,2 DIHYDROXY-1,2-
DIHYDRONAPHTHALENE
A,B1O7P0.76
PYGBENZENE-1,2,3-TRIOLA,B,C,D,E,F,
G,H,I,J,K,L
1TI40.73
PYGBENZENE-1,2,3-TRIOLM,N,O,P,Q,R,
S,T,U,V,W,X
1VLE0.73
CAQCATECHOLB2BUY0.78
CAQCATECHOLA1KND0.78
CAQCATECHOLB2BUQ0.78
CAQCATECHOLA,B1DLT0.78
CAQCATECHOLA1XEP0.78
CAQCATECHOLA2PUM0.78
EYK2-tert-butylbenzene-1,4-diolD,F3EYM0.88
EYK2-tert-butylbenzene-1,4-diolB3EYK0.88
GHP4-HYDROXYPHENYLGLYCINEA1DSR0.71
PFL2,6-BIS(1-METHYLETHYL)PHENOLA,B1E7A0.91
ZTWRALOXIFENE COREA,B1GWQ0.71
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
ANN4-METHOXYBENZOIC ACIDA2B960.71
ANN4-METHOXYBENZOIC ACIDA2QUE0.71
ANN4-METHOXYBENZOIC ACIDA1SV30.71
ANN4-METHOXYBENZOIC ACIDA1O2E0.71
ANN4-METHOXYBENZOIC ACIDA,B,C,D3CBI0.71
OTS4-(2S-AMINO-1-HYDROXYETHYL)PHENOLA,B1RG20.79
OTS4-(2S-AMINO-1-HYDROXYETHYL)PHENOLA,B1RG10.79
OTS4-(2S-AMINO-1-HYDROXYETHYL)PHENOLA,B1RH00.79
OTS4-(2S-AMINO-1-HYDROXYETHYL)PHENOLA,B1RGU0.79
OTS4-(2S-AMINO-1-HYDROXYETHYL)PHENOLA,B1RGT0.79
269(1R)-3-chloro-1-phenylpropan-1-
ol
A2RBS0.77
2AC2-AMINO-P-CRESOLH,I1A2C0.72
2AC2-AMINO-P-CRESOLA1L4M0.72
FCRALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOLA,B1E0Y0.89
FCRALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOLA,B1E8G0.89
OBZO-benzylhydroxylamineA,B3DTH0.74
OBZO-benzylhydroxylamineA,B3DTG0.74
DHCCAFFEIC ACIDA,B,C,D,E,F,
G,H
2O7D0.8
DHCCAFFEIC ACIDA1KOU0.8
5554-(4-HYDROXYPHENYL)-1-NAPHTHALDEHYDE OXIMEA,B2NV70.71
2HC(2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACIDA,B1V5Z0.86
3CH3-CHLOROPHENOLA1LI30.75
ECS2,3,17BETA-TRIHYDROXY-1,3,5(10)-
ESTRATRIENE
A,B,C,D2BW70.72
BPYBIPHENYL-2,3-DIOLA1KMY0.83
BPYBIPHENYL-2,3-DIOLB1KW80.83
BPYBIPHENYL-2,3-DIOLA2EI30.83
BPYBIPHENYL-2,3-DIOLA1EIR0.83
BPYBIPHENYL-2,3-DIOLB1KW60.83
BPYBIPHENYL-2,3-DIOLB1KWC0.83
BPYBIPHENYL-2,3-DIOLB1KW90.83
SS2(1R)-1-PHENYLETHANOLA1ZK00.85
SS2(1R)-1-PHENYLETHANOLA1ZJZ0.85
SS2(1R)-1-PHENYLETHANOLA1ZJY0.85
EGC2-(2-{2-[2-(2-{2-[2-(2-{2-[4-(1,1,3,3-
TETRAMETHYL-BUTYL)-PHENOXY]-ETHOXY}-
ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-
ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL
A,B1JP30.71
EGC2-(2-{2-[2-(2-{2-[2-(2-{2-[4-(1,1,3,3-
TETRAMETHYL-BUTYL)-PHENOXY]-ETHOXY}-
ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-
ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL
A2W220.71
RMN(R)-MANDELIC ACIDA1MDL0.7
RMN(R)-MANDELIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1MCZ0.7
TN15,6,7,8-TETRAHYDRONAPHTHALEN-1-
OL
A1YSG0.88
LZ25-hydroxynaphthalene-1-sulfonamideA2VTH0.72
DHY2-(3,4-DIHYDROXYPHENYL)ACETIC ACIDM,N,O,P,Q,R3PCN0.76
DHY2-(3,4-DIHYDROXYPHENYL)ACETIC ACIDB1AI40.76
DHY2-(3,4-DIHYDROXYPHENYL)ACETIC ACIDA,B,C,D1Q0C0.76
DHY2-(3,4-DIHYDROXYPHENYL)ACETIC ACIDA,B1F1V0.76
DIN1,6-DIHYDROXY NAPHTHALENEA1ZB60.83
OACTRANS-O-HYDROXY-ALPHA-METHYL CINNAMATEC3GCH0.81