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Ligand

NameCHEMBL359587
Molecular formulaC31H34BrCl2N3O3
IUPAC name3-[(2-bromoacetyl)amino]-N-[(2R)-2-(3,4-dichlorophenyl)-4-(4-hydroxy-4-phenylpiperidin-1-yl)butyl]-N-methylbenzamide
Molecular weight647.435
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP5.9
SynonymsN/A
Inchi KeyBYOCDQOQKLBWOV-DEOSSOPVSA-N
Inchi IDInChI=1S/C31H34BrCl2N3O3/c1-36(30(39)23-6-5-9-26(18-23)35-29(38)20-32)21-24(22-10-11-27(33)28(34)19-22)12-15-37-16-13-31(40,14-17-37)25-7-3-2-4-8-25/h2-11,18-19,24,40H,12-17,20-21H2,1H3,(H,35,38)/t24-/m0/s1
PubChem CID44394140
ChEMBLCHEMBL359587
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
35934Substance-K receptorQ64077TACR2Cavia porcellus (Guinea pig)402

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