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Ligand

NameCHEMBL48897
Molecular formulaC32H37ClN4O3S
IUPAC namepropan-2-yl N-[3-chloro-5-[[[6-[2-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethyl]-4-(2-phenylethoxy)pyridin-2-yl]amino]methyl]phenyl]carbamate
Molecular weight593.183
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP8.2
SynonymsBDBM50142772
[3-Chloro-5-({6-[2-(5-ethyl-4-methyl-thiazol-2-yl)-ethyl]-4-phenethyloxy-pyridin-2-ylamino}-methyl)-phenyl]-carbamic acid isopropyl ester
Inchi KeyAEHVGXRWBYJEPN-UHFFFAOYSA-N
Inchi IDInChI=1S/C32H37ClN4O3S/c1-5-29-22(4)35-31(41-29)12-11-26-18-28(39-14-13-23-9-7-6-8-10-23)19-30(36-26)34-20-24-15-25(33)17-27(16-24)37-32(38)40-21(2)3/h6-10,15-19,21H,5,11-14,20H2,1-4H3,(H,34,36)(H,37,38)
PubChem CID44294383
ChEMBLCHEMBL48897
IUPHARN/A
BindingDB50142772
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
3478Neuropeptide Y receptor type 1P25929NPY1RHomo sapiens (Human)384

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