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Ligand

NameCHEMBL256299
Molecular formulaC25H32ClN3O
IUPAC name2-(3-chloro-N-methylanilino)-1-[(2R,3R)-3-phenyl-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanone
Molecular weight426.001
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP5.0
SynonymsN/A
Inchi KeyDRZPPVFBGGBMTR-RPWUZVMVSA-N
Inchi IDInChI=1S/C25H32ClN3O/c1-27(22-12-7-11-21(26)17-22)19-25(30)29-16-8-13-23(20-9-3-2-4-10-20)24(29)18-28-14-5-6-15-28/h2-4,7,9-12,17,23-24H,5-6,8,13-16,18-19H2,1H3/t23-,24+/m1/s1
PubChem CID44448315
ChEMBLCHEMBL256299
IUPHARN/A
BindingDBN/A
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
67401Urotensin-2 receptorQ9UKP6UTS2RHomo sapiens (Human)389

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