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Ligand

NameCHEMBL1934414
Molecular formulaC23H34N4O3S
IUPAC name1-cyclopentyl-N-[(2S)-3,3-dimethylbutan-2-yl]-3-methyl-5-[(4-methylphenyl)sulfonylamino]pyrazole-4-carboxamide
Molecular weight446.61
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP5.0
SynonymsBDBM50419577
Inchi KeyBFODPUUHEITNCL-KRWDZBQOSA-N
Inchi IDInChI=1S/C23H34N4O3S/c1-15-11-13-19(14-12-15)31(29,30)26-21-20(22(28)24-17(3)23(4,5)6)16(2)25-27(21)18-9-7-8-10-18/h11-14,17-18,26H,7-10H2,1-6H3,(H,24,28)/t17-/m0/s1
PubChem CID57401369
ChEMBLCHEMBL1934414
IUPHARN/A
BindingDB50419577
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
22492fMet-Leu-Phe receptorP21462FPR1Homo sapiens (Human)350

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