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Ligand

NameCHEMBL287369
Molecular formulaC33H40Cl4N8O3
IUPAC name3,5-dichloro-N-[(2Z)-3-(3,4-dichlorophenyl)-5-[4-(2-oxopiperidin-1-yl)piperidin-1-yl]-2-[3-(tetrazol-1-yl)propoxyimino]pentyl]-N-methylbenzamide
Molecular weight738.536
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP6.4
SynonymsBDBM50110662
3,5-Dichloro-N-{3-(3,4-dichloro-phenyl)-5-(2-oxo-[1,4'']bipiperidinyl-1''-yl)-2-[(Z)-3-tetrazol-1-yl-propoxyimino]-pentyl}-N-methyl-benzamide
Inchi KeyAPJZDXPRSIKPNZ-KGHBKMJJSA-N
Inchi IDInChI=1S/C33H40Cl4N8O3/c1-42(33(47)24-17-25(34)20-26(35)18-24)21-31(39-48-16-4-11-44-22-38-40-41-44)28(23-6-7-29(36)30(37)19-23)10-15-43-13-8-27(9-14-43)45-12-3-2-5-32(45)46/h6-7,17-20,22,27-28H,2-5,8-16,21H2,1H3/b39-31+
PubChem CID44380290
ChEMBLCHEMBL287369
IUPHARN/A
BindingDB50110662
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
11073Substance-K receptorP21452TACR2Homo sapiens (Human)398
11074Substance-P receptorP25103TACR1Homo sapiens (Human)407

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