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Ligand

NameCHEMBL1834752
Molecular formulaC31H32FN5O2
IUPAC name6-(8-fluoro-4-methyl-1-oxophthalazin-2-yl)-N-[(1R)-6-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]pyridine-3-carboxamide
Molecular weight525.628
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.4
SynonymsBDBM50355062
Inchi KeyXRQFCDBUTIVNTI-HHHXNRCGSA-N
Inchi IDInChI=1S/C31H32FN5O2/c1-20-24-8-6-9-26(32)29(24)31(39)37(35-20)28-14-12-23(18-33-28)30(38)34-27-10-5-7-22-17-21(11-13-25(22)27)19-36-15-3-2-4-16-36/h6,8-9,11-14,17-18,27H,2-5,7,10,15-16,19H2,1H3,(H,34,38)/t27-/m1/s1
PubChem CID54772237
ChEMBLCHEMBL1834752
IUPHARN/A
BindingDB50355062
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
399182B1 bradykinin receptorP46663BDKRB1Homo sapiens (Human)353
399183B1 bradykinin receptorP48748BDKRB1Oryctolagus cuniculus (Rabbit)352

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