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Ligand

NameCHEMBL3896431
Molecular formulaC24H21ClN6O2
IUPAC name[(3R)-3-[(4-chloro-3-pyrimidin-2-ylphenyl)methyl]morpholin-4-yl]-[2-(triazol-2-yl)phenyl]methanone
Molecular weight460.922
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP3.6
SynonymsSCHEMBL14940229
US9150566, 194
BDBM184156
Inchi KeyAKVDRUIVHSDXNM-GOSISDBHSA-N
Inchi IDInChI=1S/C24H21ClN6O2/c25-21-7-6-17(15-20(21)23-26-8-3-9-27-23)14-18-16-33-13-12-30(18)24(32)19-4-1-2-5-22(19)31-28-10-11-29-31/h1-11,15,18H,12-14,16H2/t18-/m1/s1
PubChem CID89560356
ChEMBLCHEMBL3896431
IUPHARN/A
BindingDB184156
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
459288Orexin receptor type 1O43613HCRTR1Homo sapiens (Human)425
459287Orexin receptor type 2O43614HCRTR2Homo sapiens (Human)444

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