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Ligand

NameCHEMBL134737
Molecular formulaC28H28ClN3O3
IUPAC name(2-chlorophenyl)methyl N-[(2R)-3-(1H-indol-3-yl)-2-methyl-1-oxo-1-[[(1S)-1-phenylethyl]amino]propan-2-yl]carbamate
Molecular weight490.0
Hydrogen bond acceptor3
Hydrogen bond donor3
XlogP5.6
SynonymsBDBM50422067
Inchi KeyABUAYXONELMOKH-HMILPKGGSA-N
Inchi IDInChI=1S/C28H28ClN3O3/c1-19(20-10-4-3-5-11-20)31-26(33)28(2,16-22-17-30-25-15-9-7-13-23(22)25)32-27(34)35-18-21-12-6-8-14-24(21)29/h3-15,17,19,30H,16,18H2,1-2H3,(H,31,33)(H,32,34)/t19-,28+/m0/s1
PubChem CID44359259
ChEMBLCHEMBL134737
IUPHARN/A
BindingDB50422067
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1179Substance-P receptorP25103TACR1Homo sapiens (Human)407

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