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Ligand

NameCHEMBL68292
Molecular formulaC29H40N6O3
IUPAC nameN-[9-[4-[2-oxo-2-(6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)ethyl]piperazin-1-yl]nonyl]acetamide
Molecular weight520.678
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP2.5
SynonymsBDBM50012327
N-(9-{4-[2-Oxo-2-(6-oxo-5,6-dihydro-benzo[e]pyrido[3,2-b][1,4]diazepin-11-yl)-ethyl]-piperazin-1-yl}-nonyl)-acetamide
5,11-Dihydro-11-[[4-(9-acetylaminononyl)-1-piperazinyl]acetyl]-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one
Inchi KeyABZHOKIUWQKMER-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H40N6O3/c1-23(36)30-15-9-5-3-2-4-6-10-17-33-18-20-34(21-19-33)22-27(37)35-26-14-8-7-12-24(26)29(38)32-25-13-11-16-31-28(25)35/h7-8,11-14,16H,2-6,9-10,15,17-22H2,1H3,(H,30,36)(H,32,38)
PubChem CID15050958
ChEMBLCHEMBL68292
IUPHARN/A
BindingDB50012327
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
1330Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
1331Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466

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