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Ligand

NameCHEMBL508349
Molecular formulaC35H37N7O4
IUPAC name[(2R)-3-(7-methyl-1H-indazol-5-yl)-1-oxo-1-(4-pyridin-4-ylpiperazin-1-yl)propan-2-yl] 4-(2-oxo-1H-quinolin-3-yl)piperidine-1-carboxylate
Molecular weight619.726
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP3.8
SynonymsBDBM50268482
CNDMPYBCNMZLDY-WJOKGBTCSA-N
(R)-3-(7-methyl-1H-indazol-5-yl)-1-oxo-1-(4-(pyridin-4-yl)piperazin-1-yl)propan-2-yl 4-(2-oxo-1,2-dihydroquinolin-3-yl)piperidine-1-carboxylate
SCHEMBL2984411
Inchi KeyCNDMPYBCNMZLDY-WJOKGBTCSA-N
Inchi IDInChI=1S/C35H37N7O4/c1-23-18-24(19-27-22-37-39-32(23)27)20-31(34(44)41-16-14-40(15-17-41)28-6-10-36-11-7-28)46-35(45)42-12-8-25(9-13-42)29-21-26-4-2-3-5-30(26)38-33(29)43/h2-7,10-11,18-19,21-22,25,31H,8-9,12-17,20H2,1H3,(H,37,39)(H,38,43)/t31-/m1/s1
PubChem CID11512851
ChEMBLCHEMBL508349
IUPHARN/A
BindingDB50268482
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
45953Calcitonin gene-related peptide type 1 receptorQ16602CALCRLHomo sapiens (Human)461

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