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Ligand

NameAC1MCK46
Molecular formulaC19H17N5O2S
IUPAC namemethyl 1-phenyl-5-[(phenylcarbamothioylhydrazinylidene)methyl]pyrazole-4-carboxylate
Molecular weight379.438
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.3
Synonymsmethyl 1-phenyl-5-[(phenylcarbamothioylhydrazinylidene)methyl]pyrazole-4-carboxylate
HMS2788D20
MCULE-2661290397
Inchi KeyBNHOWVNWMKVGHF-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H17N5O2S/c1-26-18(25)16-12-21-24(15-10-6-3-7-11-15)17(16)13-20-23-19(27)22-14-8-4-2-5-9-14/h2-13H,1H3,(H2,22,23,27)
PubChem CID2745676
ChEMBLN/A
IUPHARN/A
BindingDB75860
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
28125G-protein coupled receptor 35Q9HC97GPR35Homo sapiens (Human)309
28124G-protein coupled receptor 55Q9Y2T6GPR55Homo sapiens (Human)319

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