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Ligand

NameCHEMBL351654
Molecular formulaC26H23N3O2
IUPAC nameN-[4-(3,9-diazatricyclo[6.4.1.04,13]trideca-1,4(13),5,7-tetraene-9-carbonyl)phenyl]-2-methylbenzamide
Molecular weight409.489
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP4.7
SynonymsN-[4-(3,4,5,6-Tetrahydro-1H-azepino[4,3,2-cd]indole-6-ylcarbonyl)phenyl]-2-methylbenzamide
Inchi KeyAFNCGNPUMCGZOJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H23N3O2/c1-17-6-2-3-8-21(17)25(30)28-20-13-11-18(12-14-20)26(31)29-15-5-7-19-16-27-22-9-4-10-23(29)24(19)22/h2-4,6,8-14,16,27H,5,7,15H2,1H3,(H,28,30)
PubChem CID44377506
ChEMBLCHEMBL351654
IUPHARN/A
BindingDBN/A
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
4286Vasopressin V2 receptorP30518AVPR2Homo sapiens (Human)371

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