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Ligand

NameCHEMBL1934418
Molecular formulaC23H34N4O3S2
IUPAC nameN-[(2S)-3,3-dimethylbutan-2-yl]-3-methyl-5-[(4-methylphenyl)sulfonylamino]-1-(thian-4-yl)pyrazole-4-carboxamide
Molecular weight478.67
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.9
SynonymsBDBM50419565
Inchi KeyCMBDQWHWALXRNJ-KRWDZBQOSA-N
Inchi IDInChI=1S/C23H34N4O3S2/c1-15-7-9-19(10-8-15)32(29,30)26-21-20(22(28)24-17(3)23(4,5)6)16(2)25-27(21)18-11-13-31-14-12-18/h7-10,17-18,26H,11-14H2,1-6H3,(H,24,28)/t17-/m0/s1
PubChem CID57396149
ChEMBLCHEMBL1934418
IUPHARN/A
BindingDB50419565
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
45176fMet-Leu-Phe receptorP21462FPR1Homo sapiens (Human)350

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