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Ligand

NameCHEMBL3897947
Molecular formulaC30H35ClN6O
IUPAC name6-(5-chloro-2-methylphenyl)-2-(3,5-dimethyl-2H-indazol-4-yl)-4-[(2S,4S)-4-methoxy-2-methylpiperidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
Molecular weight531.101
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP6.2
SynonymsN/A
Inchi KeyBJZNBLNWGJBCGY-UGKGYDQZSA-N
Inchi IDInChI=1S/C30H35ClN6O/c1-17-6-8-21(31)15-26(17)36-12-11-24-23(16-36)30(37-13-10-22(38-5)14-19(37)3)33-29(32-24)27-18(2)7-9-25-28(27)20(4)34-35-25/h6-9,15,19,22H,10-14,16H2,1-5H3,(H,34,35)/t19-,22-/m0/s1
PubChem CID134134254
ChEMBLCHEMBL3897947
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
548170C5a anaphylatoxin chemotactic receptor 1P21730C5AR1Homo sapiens (Human)350

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