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Ligand

NameCHEMBL3895276
Molecular formulaC31H40N8O
IUPAC name6-(5-cyclopropyl-2-methylpyrazol-3-yl)-2-(3,5-dimethyl-2H-indazol-4-yl)-4-[(4S)-4-methoxy-3,3-dimethylpiperidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
Molecular weight540.716
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.9
SynonymsN/A
Inchi KeyCGJKBKFUADPKTN-VWLOTQADSA-N
Inchi IDInChI=1S/C31H40N8O/c1-18-7-10-23-28(19(2)34-35-23)27(18)29-32-22-11-13-38(26-15-24(20-8-9-20)36-37(26)5)16-21(22)30(33-29)39-14-12-25(40-6)31(3,4)17-39/h7,10,15,20,25H,8-9,11-14,16-17H2,1-6H3,(H,34,35)/t25-/m0/s1
PubChem CID134137602
ChEMBLCHEMBL3895276
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
548351C5a anaphylatoxin chemotactic receptor 1P21730C5AR1Homo sapiens (Human)350

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