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Ligand

NameCHEMBL296365
Molecular formulaC22H27N5O2
IUPAC name11-[2-[2-(ethylaminomethyl)piperidin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
Molecular weight393.491
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP1.1
Synonyms11-[2-(2-Ethylaminomethyl-piperidin-1-yl)-acetyl]-5,11-dihydro-benzo[e]pyrido[3,2-b][1,4]diazepin-6-one
BDBM50018301
11-[[2-[(Ethylamino)methyl]piperidin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6(11H)-one
Inchi KeyCXNAKWIKEHZMNI-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H27N5O2/c1-2-23-14-16-8-5-6-13-26(16)15-20(28)27-19-11-4-3-9-17(19)22(29)25-18-10-7-12-24-21(18)27/h3-4,7,9-12,16,23H,2,5-6,8,13-15H2,1H3,(H,25,29)
PubChem CID14590399
ChEMBLCHEMBL296365
IUPHARN/A
BindingDB50018301
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
52938Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466
52937Muscarinic acetylcholine receptor M3P08483Chrm3Rattus norvegicus (Rat)589

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