Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02300857
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
HE7 | 4-{[(14beta,17alpha)-3-hydroxyestra- 1,3,5(10)-trien-17-yl]oxy}-4-oxobutanoic acid | A,B,C,D | 2Z77 | 0.72 | |
MBD | 3-METHYLCATECHOL | A | 1KNF | 0.85 | |
OBP | A,B | 2DE3 | 0.75 | ||
LYL | 2-ALLYL-6-METHYL-PHENOL | A | 1OV7 | 0.78 | |
FPN | 4-FLUOROPHENOL | A,B | 1XVD | 0.71 | |
3HP | 3-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCE | 0.71 | |
TON | 2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOL | A,B | 1SEZ | 0.74 | |
TF5 | 2-[(2',3',4'-TRIFLUOROBIPHENYL- 2-YL)OXY]ETHANOL | A,B | 2OP3 | 0.74 | |
ESL | ESTRIOL | A | 1X8V | 0.8 | |
TTO | (3,4-DIHYDROXY-PHENYL)-TRIPHENYL- ARSONIUM | A | 1HYZ | 0.76 | |
Y13 | (2E)-3-(3,4-DIHYDROXYPHENYL)-N- [2-(4-HYDROXYPHENYL)ETHYL]ACRYLAMIDE | A | 2EW6 | 0.72 | |
E3O | (16ALPHA,17ALPHA)-ESTRA-1,3,5(10)- TRIENE-3,16,17-TRIOL | A | 2J7Y | 0.8 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | H,I | 1A2C | 0.7 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C | 1CA7 | 0.7 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C,D | 3GGO | 0.7 | |
LDP | L-DOPAMINE | A,B | 2A3R | 0.78 | |
LDP | L-DOPAMINE | A | 5PAH | 0.78 | |
LDP | L-DOPAMINE | A,B | 2QMZ | 0.78 | |
LDP | L-DOPAMINE | A,B | 2VQ5 | 0.78 | |
EQU | EQUILENIN | A,B | 1OGX | 0.75 | |
EQU | EQUILENIN | A,B,C,D,E,F | 1QJG | 0.75 | |
EQU | EQUILENIN | A,B | 1OH0 | 0.75 | |
EQU | EQUILENIN | A | 1W6Y | 0.75 | |
EQU | EQUILENIN | A,B | 1CQS | 0.75 | |
EQU | EQUILENIN | A | 1OGZ | 0.75 | |
EQU | EQUILENIN | A | 1GS3 | 0.75 | |
EQU | EQUILENIN | A | 1OHO | 0.75 | |
1NP | 1-NAPHTHOL | X | 2ZVQ | 0.8 | |
BP7 | 1,1'-BIPHENYL-3,4-DIOL | A | 2EI0 | 0.93 | |
BPZ | 4,4'-cyclohexane-1,1-diyldiphenol | A | 2ZKC | 0.86 | |
MAX | MATAIRESINOL | A | 2BGM | 0.76 | |
ECS | 2,3,17BETA-TRIHYDROXY-1,3,5(10)- ESTRATRIENE | A,B,C,D | 2BW7 | 0.83 | |
BPY | BIPHENYL-2,3-DIOL | A | 1KMY | 0.91 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KW8 | 0.91 | |
BPY | BIPHENYL-2,3-DIOL | A | 2EI3 | 0.91 | |
BPY | BIPHENYL-2,3-DIOL | A | 1EIR | 0.91 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KW6 | 0.91 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KWC | 0.91 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KW9 | 0.91 | |
LJ1 | 2,6-dimethyl-4-[(E)-2-phenylethenyl]phenol | A,B | 3CN0 | 0.83 | |
369 | 5-(4-hydroxyphenoxy)-6-(3-hydroxyphenyl)- 7-methylnaphthalen-2-ol | A,B | 3DT3 | 0.7 | |
JPN | 2-(2,4-DICHLOROPHENOXY)-5-(3-PHENYLPROPYL)PHENOL | A,B | 2OL4 | 0.71 | |
TCT | 6-(4-CHLORO-2-HYDROXY-PHENOXY)- NAPHTHALEN-2-OL | A,B | 1NNU | 0.7 | |
NE2 | 3,3',4',5-TETRACHLOROBIPHENYL-4- OL | A,B | 2GAB | 0.7 | |
HFL | 5-(3,3-DIHYDROXYPROPENY)-3-METHOXY- BENZENE-1,2-DIOL | C,F | 1KYW | 0.7 | |
TRT | FRAGMENT OF TRITON X-100 | A,E | 2I0U | 0.7 | |
TRT | FRAGMENT OF TRITON X-100 | A,B | 1OIZ | 0.7 | |
ESM | 1,3,5(10)-ESTRATRIEN-2,3,17-BETA- TRIOL 2-METHYL ETHER | A | 1LHW | 0.76 | |
17M | 17-METHYL-17-ALPHA-DIHYDROEQUILENIN | A,B | 2B1Z | 0.79 | |
JPJ | 2-(2,4-DICHLOROPHENOXY)-5-(2-PHENYLETHYL)PHENOL | A,B | 2OOS | 0.71 | |
JPJ | 2-(2,4-DICHLOROPHENOXY)-5-(2-PHENYLETHYL)PHENOL | A | 3FNH | 0.71 | |
H53 | 2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE- 3,4,5-TRIOL | A | 2FF5 | 0.73 | |
H53 | 2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE- 3,4,5-TRIOL | A | 2FET | 0.73 | |
ANF | ANTHRONE | H | 2BJM | 0.77 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E0Y | 0.76 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E8G | 0.76 | |
BM4 | 3-[(3R)-3-ethyl-1-{9-[(3S)-3-ethyl- 3-(3-hydroxyphenyl)azepan-1-yl]nonyl}azepan- 3-yl]phenol | X | 2W6C | 0.71 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B | 2TPL | 0.74 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B,C,D | 3GGP | 0.74 | |
BHQ | 2,5-DITERT-BUTYLBENZENE-1,4-DIOL | A,B | 2AGV | 0.79 | |
55E | 4-(4-hydroxy-3-methylphenyl)-6- phenylpyrimidin-2(5H)-one | A | 3DCV | 0.71 | |
JPM | 5-benzyl-2-(2,4-dichlorophenoxy)phenol | A,B,C,D | 3FNF | 0.7 | |
PFI | (6S)-6-CYCLOPENTYL-6-[2-(3-FLUORO- 4-ISOPROPOXYPHENYL)ETHYL]-4-HYDROXY- 5,6-DIHYDRO-2H-PYRAN-2-ONE | A | 2HAI | 0.7 | |
UQ6 | 5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA- 2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY- 6-METHYL-BENZENE-1,4-DIOL | C,D,E | 1EZV | 0.7 | |
UQ6 | 5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA- 2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY- 6-METHYL-BENZENE-1,4-DIOL | A,C,D,E | 1P84 | 0.7 | |
UQ6 | 5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA- 2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY- 6-METHYL-BENZENE-1,4-DIOL | C,D,E | 2IBZ | 0.7 | |
UQ6 | 5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA- 2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY- 6-METHYL-BENZENE-1,4-DIOL | A,C,D,E | 1KB9 | 0.7 | |
ETC | (R,R)-5,11-CIS-DIETHYL-5,6,11,12- TETRAHYDROCHRYSENE-2,8-DIOL | A,B | 1L2I | 0.85 | |
ETC | (R,R)-5,11-CIS-DIETHYL-5,6,11,12- TETRAHYDROCHRYSENE-2,8-DIOL | A,B | 1L2J | 0.85 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.8 | |
555 | 4-(4-HYDROXYPHENYL)-1-NAPHTHALDEHYDE OXIME | A,B | 2NV7 | 0.72 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 1G3M | 0.72 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 2G5U | 0.72 | |
178 | 4-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)- 2-ISOPROPYLPHENOL | A,B | 1TVE | 0.78 | |
AEG | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.71 | |
2E3 | (2E)-3-[4-hydroxy-3-(3,5,5,8,8- pentamethyl-5,6,7,8-tetrahydronaphthalen- 2-yl)phenyl]prop-2-enoic acid | A | 3FUG | 0.76 | |
JPL | 5-(cyclohexa-1,5-dien-1-ylmethyl)- 2-(2,4-dichlorophenoxy)phenol | A | 3FNG | 0.71 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.87 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.87 | |
AEH | 4-(2-aminoethyl)-2-ethylphenol | A | 3BUG | 0.72 | |
STL | RESVERATROL | A,B | 3CKL | 0.79 | |
STL | RESVERATROL | A,B,C,D | 1U0W | 0.79 | |
STL | RESVERATROL | A | 1CGZ | 0.79 | |
STL | RESVERATROL | A,B,C,D,E,F, G,H,I,J,K,L, M,N | 2JIZ | 0.79 | |
STL | RESVERATROL | A | 1Z1F | 0.79 | |
STL | RESVERATROL | A | 1DVS | 0.79 | |
STL | RESVERATROL | A,B | 1SG0 | 0.79 | |
OAC | TRANS-O-HYDROXY-ALPHA-METHYL CINNAMATE | C | 3GCH | 0.72 | |
43M | 4-CHLORO-3-METHYLPHENOL | A | 2P7A | 0.7 | |
NDH | (1R, 2S)-CIS 1,2 DIHYDROXY-1,2- DIHYDRONAPHTHALENE | A,B | 1O7P | 0.7 | |
1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 2BXE | 0.73 | |
1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 3D2T | 0.73 | |
PFL | 2,6-BIS(1-METHYLETHYL)PHENOL | A,B | 1E7A | 0.81 | |
G24 | [4-(3-BENZYL-4-HYDROXYBENZYL)-3,5- DIMETHYLPHENOXY]ACETIC ACID | A | 1Q4X | 0.72 | |
AEF | 4-(2-aminoethyl)phenol | A | 3BRA | 0.71 | |
BPM | 4-PHOSPHONOOXY-PHENYL-METHYL-[4- PHOSPHONOOXY]BENZEN | A | 1AAX | 0.74 | |
DRQ | (9ALPHA,13BETA,17BETA)-2-[(1Z)- BUT-1-EN-1-YL]ESTRA-1,3,5(10)-TRIENE- 3,17-DIOL | A,B | 2G5O | 0.77 | |
ALE | L-EPINEPHRINE | A | 3PAH | 0.7 | |
ALE | L-EPINEPHRINE | A | 2HKK | 0.7 | |
4HP | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.73 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.73 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.73 | |
4HP | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.73 | |
4HP | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.73 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A | 2QU9 | 0.78 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1QLU | 0.78 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1J | 0.78 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 2VAO | 0.78 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1K | 0.78 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1DZN | 0.78 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1L | 0.78 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1M | 0.78 | |
T3O | 4-[(1S,2R,5S)-4,4,8-TRIMETHYL-3- OXABICYCLO[3.3.1]NON-7-EN-2-YL]PHENOL | A,B | 2G44 | 0.76 | |
D1N | NAPHTHALENE-1,2-DIOL | A | 2EI1 | 0.87 | |
HC4 | A | 1TS6 | 0.73 | ||
HC4 | A | 3PHY | 0.73 | ||
HC4 | A | 3PYP | 0.73 | ||
HC4 | A | 1T1C | 0.73 | ||
HC4 | A | 1OT6 | 0.73 | ||
HC4 | A | 1TS0 | 0.73 | ||
HC4 | A | 1T1A | 0.73 | ||
HC4 | A | 2PYP | 0.73 | ||
HC4 | A | 2ZOI | 0.73 | ||
HC4 | A | 1OTI | 0.73 | ||
HC4 | A | 1XFQ | 0.73 | ||
HC4 | A | 2D01 | 0.73 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7B | 0.73 | ||
HC4 | A | 2ZOH | 0.73 | ||
HC4 | A | 1GSW | 0.73 | ||
HC4 | A | 2QJ7 | 0.73 | ||
HC4 | A | 1F9I | 0.73 | ||
HC4 | X | 1UWP | 0.73 | ||
HC4 | A | 2PHY | 0.73 | ||
HC4 | A | 1T1B | 0.73 | ||
HC4 | A | 1F98 | 0.73 | ||
HC4 | A | 1T19 | 0.73 | ||
HC4 | X | 1UWN | 0.73 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7F | 0.73 | ||
HC4 | A | 1UGU | 0.73 | ||
HC4 | A | 1TS8 | 0.73 | ||
HC4 | A,B | 1OTD | 0.73 | ||
HC4 | A | 1OTE | 0.73 | ||
HC4 | A | 1GSX | 0.73 | ||
HC4 | A | 1TS7 | 0.73 | ||
HC4 | A | 2PYR | 0.73 | ||
HC4 | A | 1S4S | 0.73 | ||
HC4 | A | 1GSV | 0.73 | ||
HC4 | A | 2I9V | 0.73 | ||
HC4 | A | 2QWS | 0.73 | ||
HC4 | A | 1XFN | 0.73 | ||
HC4 | A | 1S4R | 0.73 | ||
HC4 | A | 1T18 | 0.73 | ||
HC4 | A | 1OTA | 0.73 | ||
HC4 | A | 1D7E | 0.73 | ||
HC4 | A | 1S1Z | 0.73 | ||
HC4 | A,B,C | 1MZU | 0.73 | ||
HC4 | A,B | 1ODV | 0.73 | ||
HC4 | A,B | 2J3J | 0.73 | ||
HC4 | A | 2QJ5 | 0.73 | ||
HC4 | A | 1OTB | 0.73 | ||
HC4 | A | 2D02 | 0.73 | ||
HC4 | A | 1OT9 | 0.73 | ||
HC4 | A | 1NWZ | 0.73 | ||
HC4 | A | 1S1Y | 0.73 | ||
4NA | 1-CHLORO-6-(4-HYDROXYPHENYL)-2- NAPHTHOL | A,B | 1YY4 | 0.72 | |
EST | ESTRADIOL | A,B | 1GWR | 0.79 | |
EST | ESTRADIOL | A | 1FDS | 0.79 | |
EST | ESTRADIOL | A,B,C | 1G50 | 0.79 | |
EST | ESTRADIOL | A,B,C,D,E,F | 1ERE | 0.79 | |
EST | ESTRADIOL | A,B | 1A52 | 0.79 | |
EST | ESTRADIOL | A | 1FDT | 0.79 | |
EST | ESTRADIOL | A | 2OCF | 0.79 | |
EST | ESTRADIOL | A,B,C | 1QKU | 0.79 | |
EST | ESTRADIOL | A,B,C,D,L | 1E6W | 0.79 | |
EST | ESTRADIOL | A | 1IOL | 0.79 | |
EST | ESTRADIOL | H | 1JNN | 0.79 | |
EST | ESTRADIOL | B | 1QKT | 0.79 | |
EST | ESTRADIOL | A | 1FDW | 0.79 | |
EST | ESTRADIOL | A,B | 1AQU | 0.79 | |
EST | ESTRADIOL | A | 1LHU | 0.79 | |
EST | ESTRADIOL | A | 1A27 | 0.79 | |
EST | ESTRADIOL | L | 1JGL | 0.79 | |
EST | ESTRADIOL | A,B,E,F | 1PCG | 0.79 | |
EST | ESTRADIOL | A,B,C,D | 1FDU | 0.79 | |
EST | ESTRADIOL | A | 2J7X | 0.79 | |
EST | ESTRADIOL | A,B | 2D06 | 0.79 | |
DIN | 1,6-DIHYDROXY NAPHTHALENE | A | 1ZB6 | 0.81 | |
OXN | OXTOXYNOL-10 | A | 1IKT | 0.71 | |
OXN | OXTOXYNOL-10 | A,B | 2Q32 | 0.71 | |
OXN | OXTOXYNOL-10 | A,B | 1UEH | 0.71 | |
OXN | OXTOXYNOL-10 | A,B | 2D4Q | 0.71 | |
OHP | (2-HYDROXYPHENYL)ACETIC ACID | A | 2INZ | 0.7 | |
BP3 | 2'-CHLORO-BIPHENYL-2,3-DIOL | A | 1LGT | 0.83 | |
IM3 | (2E)-3-(3,4-DIHYDROXYPHENYL)-2- IMINOPROPANOIC ACID | A,B,C,D | 2E82 | 0.72 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.87 | |
DES | DIETHYLSTILBESTROL | A,B | 3ERD | 0.87 | |
DES | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.87 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.87 | |
BP6 | 2',6'-DICHLORO-BIPHENYL-2,6-DIOL | A | 1LKD | 0.81 | |
EGT | 2-(3,4,5-TRIHYDROXY-PHENYL)-CHROMAN- 3,5,7-TRIOL | A | 1JNQ | 0.7 | |
EPT | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.83 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2QZZ | 0.74 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2R2G | 0.74 | |
458 | 4-[(1S,2S,5S)-5-(HYDROXYMETHYL)- 8-METHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL | A,B | 2B1V | 0.73 | |
DHC | CAFFEIC ACID | A,B,C,D,E,F, G,H | 2O7D | 0.79 | |
DHC | CAFFEIC ACID | A | 1KOU | 0.79 | |
DR6 | ALPHA-[4-(1,1,3,3 - TETRAMETHYLBUTYL)PHENYL]- OMEGA-HYDROXY-POLY(OXY-1,2-ETHANEDIYL) | C,I,T | 1YTZ | 0.7 | |
689 | 4-[(1S,2S,5S)-5-(HYDROXYMETHYL)- 6,8,9-TRIMETHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL | A,B | 1ZKY | 0.74 | |
CAQ | CATECHOL | B | 2BUY | 0.74 | |
CAQ | CATECHOL | A | 1KND | 0.74 | |
CAQ | CATECHOL | B | 2BUQ | 0.74 | |
CAQ | CATECHOL | A,B | 1DLT | 0.74 | |
CAQ | CATECHOL | A | 1XEP | 0.74 | |
CAQ | CATECHOL | A | 2PUM | 0.74 | |
OX4 | 3-FLUORO-4-HYDROXYBENZALDEHYDE O- (CYCLOHEXYLCARBONYL)OXIME | A,B,C | 2OOW | 0.71 | |
196 | 3-(3-FLUORO-4-HYDROXYPHENYL)-7- HYDROXY-1-NAPHTHONITRILE | A,B | 1YYE | 0.79 | |
IPB | 5-METHYL-2-(1-METHYLETHYL)PHENOL | A,B | 1E06 | 0.83 | |
SRL | [2-(3,5-DI-TERT-BUTYL-4-HYDROXY- PHENYL)-1-(DIETHOXY-PHOSPHORYL)- VINYL]-PHOSPHONIC ACID DIETHLYL ESTER | A | 1ILH | 0.72 | |
SRL | [2-(3,5-DI-TERT-BUTYL-4-HYDROXY- PHENYL)-1-(DIETHOXY-PHOSPHORYL)- VINYL]-PHOSPHONIC ACID DIETHLYL ESTER | A,B | 1NRL | 0.72 | |
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.91 | |
LJ3 | 3,5-dibromobiphenyl-4-ol | A,B | 3CN2 | 0.75 | |
PCR | P-CRESOL | A | 1JHV | 0.78 | |
PCR | P-CRESOL | A | 1JHU | 0.78 | |
PCR | P-CRESOL | A,B,C,D | 1DIQ | 0.78 | |
FBR | (9aS)-4-bromo-9a-butyl-7-hydroxy- 1,2,9,9a-tetrahydro-3H-fluoren- 3-one | A | 2GIU | 0.71 | |
W29 | 4-(3-ethylthiophen-2-yl)benzene- 1,2-diol | A | 3D27 | 0.76 | |
LNR | L-NOREPINEPHRINE | A,B | 2QEO | 0.73 | |
LNR | L-NOREPINEPHRINE | A | 3DYE | 0.73 | |
LNR | L-NOREPINEPHRINE | A | 4PAH | 0.73 | |
MCT | 4-METHYLCATECHOL | A | 1L4G | 0.86 | |
MCT | 4-METHYLCATECHOL | A | 2EHZ | 0.86 | |
MCT | 4-METHYLCATECHOL | A,B | 1DMH | 0.86 | |
FP2 | 2-fluorophenol | A | 3CPO | 0.71 | |
2HC | (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID | A,B | 1V5Z | 0.72 | |
3TN | (2E)-3-[4-HYDROXY-3-(3-METHOXY- 5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN- 2-YL)PHENYL]ACRYLIC ACID | A | 2P1T | 0.71 | |
DHR | (2S)-HYDROXY(4-HYDROXYPHENYL)ETHANENITRILE | A,B | 1E55 | 0.71 | |
EZT | (17BETA)-17-{(E)-2-[2-(TRIFLUOROMETHYL)PHENYL]VINYL}ESTRA- 1(10),2,4-TRIENE-3,17-DIOL | A,B | 2P15 | 0.81 | |
LZ2 | 5-hydroxynaphthalene-1-sulfonamide | A | 2VTH | 0.7 | |
R12 | 9-(4-HYDROXY-2,6-DIMETHYL-PHENYL)- 3,7-DIMETHYL-NONA-4,6,8-TRIENOIC ACID | A | 3CBS | 0.81 | |
4FE | (2E)-3-(3-hydroxy-4-methoxyphenyl)prop- 2-enoic acid | A | 3CBG | 0.73 | |
1OH | 4-(1-methyl-1-phenylethyl)phenol | A | 2ZAS | 0.86 | |
2MP | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.82 | |
3AS | (3aS,4R,9bR)-2,2-difluoro-4-(4- hydroxyphenyl)-6-(methoxymethyl)- 1,2,3,3a,4,9b-hexahydrocyclopenta[c]chromen- 8-ol | A,B | 2QTU | 0.7 | |
3FA | 3-FLUOROBENZENE-1,2-DIOL | A | 2AS4 | 0.77 | |
JPA | 4-(2,4-DICHLOROPHENOXY)-2'-METHYLBIPHENYL- 3-OL | A,B | 2FOI | 0.71 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A | 2OPA | 0.74 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B,C | 1MFI | 0.74 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B | 1GYY | 0.74 | |
8PP | 2-[(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,D | 1Y0G | 0.8 | |
EYK | 2-tert-butylbenzene-1,4-diol | D,F | 3EYM | 0.81 | |
EYK | 2-tert-butylbenzene-1,4-diol | B | 3EYK | 0.81 | |
2LP | 2-ALLYLPHENOL | A | 1OV5 | 0.78 | |
EED | (9BETA,11ALPHA,13ALPHA,14BETA,17ALPHA)- 11-(METHOXYMETHYL)ESTRA-1(10),2,4- TRIENE-3,17-DIOL | A,B | 2QGT | 0.76 | |
CRS | M-CRESOL | A,B,C,D | 1EV3 | 0.79 | |
CRS | M-CRESOL | A,B,C,D,E,F | 2OMG | 0.79 | |
CRS | M-CRESOL | A,B | 1UZ9 | 0.79 | |
CRS | M-CRESOL | A,B,C,D | 1ZEH | 0.79 | |
CRS | M-CRESOL | A,B,C,D,E,F | 1ZEI | 0.79 | |
CRS | M-CRESOL | A,C,D,E | 7INS | 0.79 | |
CRS | M-CRESOL | A,B,C,D,E,G, I,K | 1EV6 | 0.79 | |
459 | 4-[(1S,2S,5S,9R)-5-(HYDROXYMETHYL)- 8,9-DIMETHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL | A,B | 2FAI | 0.76 | |
226 | naphthalene-1,2,4,5,7-pentol | A,B | 2NZ5 | 0.79 | |
DC8 | (3AS,4R,9BR)-2,2-DIFLUORO-4-(4- HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL | A,B | 2Q70 | 0.72 | |
DC8 | (3AS,4R,9BR)-2,2-DIFLUORO-4-(4- HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL | A,B | 2Z4B | 0.72 | |
EQI | EQUILIN | A,B | 1EQU | 0.76 | |
SDT | 3,4-dihydroxy-9,10-secoandrosta- 1(10),2,4-triene-9,17-dione | A,B | 2ZI8 | 0.81 | |
ODE | DIETHYL (1R,2S,3R,4S)-5,6-BIS(4- HYDROXYPHENYL)-7-OXABICYCLO[2.2.1]HEPT- 5-ENE-2,3-DICARBOXYLATE | A,B | 2QH6 | 0.7 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,C,E | 1KYZ | 0.73 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1JT2 | 0.73 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 6ATJ | 0.73 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1GKL | 0.73 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GWT | 0.73 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B,C | 2BJH | 0.73 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GW2 | 0.73 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 3CBG | 0.73 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 2BNJ | 0.73 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1UWC | 0.73 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 7ATJ | 0.73 | |
LJ2 | 2,6-dibromo-4-[(E)-2-phenylethenyl]phenol | A,B | 3CN1 | 0.71 | |
AED | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.75 | |
8PS | 5-OCTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B37 | 0.84 | |
DBE | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.73 | |
5PP | 5-PENTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B36 | 0.84 | |
I0G | (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL | A,B | 2I0G | 0.71 | |
I0G | (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL | A,B,C,D | 2I0J | 0.71 | |
PIT | PICEATANNOL | A,B,C,D,E,F, G,H,I,J,K,L, M,N | 2JJ1 | 0.83 | |
TN1 | 5,6,7,8-TETRAHYDRONAPHTHALEN-1- OL | A | 1YSG | 0.81 | |
YR3 | (2S)-3-{4-[1-ethyl-1-(4-{[(2R)- 2-hydroxy-3,3-dimethylbutyl]oxy}- 3-methylphenyl)propyl]-2-methylphenoxy}propane- 1,2-diol | A | 2ZFX | 0.73 | |
EGC | 2-(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,B | 1JP3 | 0.71 | |
EGC | 2-(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 | 2W22 | 0.71 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | M,N,O,P,Q,R | 3PCN | 0.76 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | B | 1AI4 | 0.76 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D | 1Q0C | 0.76 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B | 1F1V | 0.76 |