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Ligand

NameCHEMBL243503
Molecular formulaC30H41N5O4S
IUPAC name1-[(4-methylsulfanylphenyl)carbamoylamino]-N-[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxo-3-phenylpropan-2-yl]cyclopentane-1-carboxamide
Molecular weight567.749
Hydrogen bond acceptor6
Hydrogen bond donor4
XlogP3.2
SynonymsN/A
Inchi KeyJGINCGJWTJZBCW-AREMUKBSSA-N
Inchi IDInChI=1S/C30H41N5O4S/c1-40-25-12-10-24(11-13-25)32-29(38)34-30(14-5-6-15-30)28(37)33-26(22-23-8-3-2-4-9-23)27(36)31-16-7-17-35-18-20-39-21-19-35/h2-4,8-13,26H,5-7,14-22H2,1H3,(H,31,36)(H,33,37)(H2,32,34,38)/t26-/m1/s1
PubChem CID23625634
ChEMBLCHEMBL243503
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
150303Substance-K receptorP21452TACR2Homo sapiens (Human)398
150304Substance-K receptorQ64077TACR2Cavia porcellus (Guinea pig)402

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