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Ligand

NameCHEMBL1554845
Molecular formulaC16H17ClN4O3
IUPAC namemethyl 4-chloro-2-[(2-methyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidine-4-carbonyl)amino]benzoate
Molecular weight348.787
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.8
SynonymsNCGC00127404-01
MCULE-1779747345
ZINC8598245
AKOS001940334
E988-0043
[ Show all ]
Inchi KeyAFTAEEALTPFSDY-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H17ClN4O3/c1-10-8-14-20(6-3-7-21(14)19-10)16(23)18-13-9-11(17)4-5-12(13)15(22)24-2/h4-5,8-9H,3,6-7H2,1-2H3,(H,18,23)
PubChem CID16024370
ChEMBLCHEMBL1554845
IUPHARN/A
BindingDBN/A
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
463430Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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