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Ligand

NameCHEMBL395975
Molecular formulaC31H37ClN4O4S
IUPAC name7-chloro-N-[1-[[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]cyclopentyl]-1-benzothiophene-2-carboxamide
Molecular weight597.171
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP4.9
SynonymsN/A
Inchi KeyJGPVMVGMLHDLCW-RUZDIDTESA-N
Inchi IDInChI=1S/C31H37ClN4O4S/c32-24-11-6-10-23-21-26(41-27(23)24)29(38)35-31(12-4-5-13-31)30(39)34-25(20-22-8-2-1-3-9-22)28(37)33-14-7-15-36-16-18-40-19-17-36/h1-3,6,8-11,21,25H,4-5,7,12-20H2,(H,33,37)(H,34,39)(H,35,38)/t25-/m1/s1
PubChem CID23626900
ChEMBLCHEMBL395975
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
150510Substance-K receptorP21452TACR2Homo sapiens (Human)398
150511Substance-K receptorQ64077TACR2Cavia porcellus (Guinea pig)402

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