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Ligand

NameCHEMBL1082190
Molecular formulaC24H23N5O2
IUPAC name[(3S)-4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-yl]-[4-(1H-pyrazol-4-yl)phenyl]methanone
Molecular weight413.481
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP2.8
SynonymsBDBM50312797
(S)-(4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-yl)(4-(1H-pyrazol-4-yl)phenyl)methanone
Inchi KeyVMKBNLCHMKVTEY-INIZCTEOSA-N
Inchi IDInChI=1S/C24H23N5O2/c1-16-15-28(23(30)19-5-2-17(3-6-19)21-13-26-27-14-21)10-11-29(16)24(31)20-7-4-18-8-9-25-22(18)12-20/h2-9,12-14,16,25H,10-11,15H2,1H3,(H,26,27)/t16-/m0/s1
PubChem CID46880814
ChEMBLCHEMBL1082190
IUPHARN/A
BindingDB50312797
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
358646Growth hormone secretagogue receptor type 1O08725GhsrRattus norvegicus (Rat)364
358647Growth hormone secretagogue receptor type 1Q92847GHSRHomo sapiens (Human)366

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