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Ligand

NameCHEMBL490852
Molecular formulaC23H27Cl2N3O4
IUPAC name2-[4-[[2-(2-chlorophenyl)acetyl]amino]piperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate
Molecular weight480.386
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP3.8
SynonymsBDBM29527
ML10302 scaffold, 9{a;q}
Inchi KeyBMOODWZWOWBVJA-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H27Cl2N3O4/c1-31-21-14-20(26)19(25)13-17(21)23(30)32-11-10-28-8-6-16(7-9-28)27-22(29)12-15-4-2-3-5-18(15)24/h2-5,13-14,16H,6-12,26H2,1H3,(H,27,29)
PubChem CID42618248
ChEMBLCHEMBL490852
IUPHARN/A
BindingDB29527
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
276635-hydroxytryptamine receptor 4Q13639HTR4Homo sapiens (Human)388

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