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Ligand

NameCHEMBL1766108
Molecular formulaC29H30ClN5O2
IUPAC name7-chloro-3-(3,5-dimethylphenyl)-4-[2-[(2R)-piperidin-2-yl]ethoxy]-N-pyrimidin-4-ylquinoline-6-carboxamide
Molecular weight516.042
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP5.4
SynonymsBDBM50341561
(R)-7-chloro-3-(3,5-dimethylphenyl)-4-(2-(piperidin-2-yl)ethoxy)-N-(pyrimidin-4-yl)quinoline-6-carboxamide
Inchi KeyBMJFEESLJOXGMQ-OAQYLSRUSA-N
Inchi IDInChI=1S/C29H30ClN5O2/c1-18-11-19(2)13-20(12-18)24-16-33-26-15-25(30)22(29(36)35-27-6-9-31-17-34-27)14-23(26)28(24)37-10-7-21-5-3-4-8-32-21/h6,9,11-17,21,32H,3-5,7-8,10H2,1-2H3,(H,31,34,35,36)/t21-/m1/s1
PubChem CID54584354
ChEMBLCHEMBL1766108
IUPHARN/A
BindingDB50341561
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
27547Gonadotropin-releasing hormone receptorP30968GNRHRHomo sapiens (Human)328
27548Somatostatin receptor type 2P30874SSTR2Homo sapiens (Human)369

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