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Ligand

NameCHEMBL68771
Molecular formulaC20H24N6O2
IUPAC name11-[2-[4-(2-aminoethyl)piperazin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
Molecular weight380.452
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP-0.8
Synonyms6H-Pyrido[2,3-b][1,4]benzodiazepin-6-one, 11-[[4-(2-aminoethyl)-1-piperazinyl]acetyl]-5,11-dihydro-
HMS3340F04
11-[2-[4-(2-aminoethyl)piperazin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
BGBFZLZJWJZOCZ-UHFFFAOYSA-N
SMR000486248
[ Show all ]
Inchi KeyBGBFZLZJWJZOCZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H24N6O2/c21-7-9-24-10-12-25(13-11-24)14-18(27)26-17-6-2-1-4-15(17)20(28)23-16-5-3-8-22-19(16)26/h1-6,8H,7,9-14,21H2,(H,23,28)
PubChem CID611101
ChEMBLCHEMBL68771
IUPHARN/A
BindingDB50012339
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
22822Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
22821Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466
22820Muscarinic acetylcholine receptor M3P08483Chrm3Rattus norvegicus (Rat)589
22823Muscarinic acetylcholine receptor M4P08485Chrm4Rattus norvegicus (Rat)478

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