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Ligand

NameCHEMBL325742
Molecular formulaC26H23Cl2N3O4S
IUPAC namebenzyl N-[2-[2,4-dichloro-N-methyl-3-[(2-methyl-1,3-benzothiazol-4-yl)oxymethyl]anilino]-2-oxoethyl]carbamate
Molecular weight544.447
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP6.1
SynonymsBDBM50074996
SCHEMBL8632906
({[2,4-Dichloro-3-(2-methyl-benzothiazol-4-yloxymethyl)-phenyl]-methyl-carbamoyl}-methyl)-carbamic acid benzyl ester
Inchi KeyBVOSSPZCIPMSJY-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H23Cl2N3O4S/c1-16-30-25-21(9-6-10-22(25)36-16)34-15-18-19(27)11-12-20(24(18)28)31(2)23(32)13-29-26(33)35-14-17-7-4-3-5-8-17/h3-12H,13-15H2,1-2H3,(H,29,33)
PubChem CID15388870
ChEMBLCHEMBL325742
IUPHARN/A
BindingDB50074996
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
33937B2 bradykinin receptorO70526BDKRB2Cavia porcellus (Guinea pig)372
33938B2 bradykinin receptorP30411BDKRB2Homo sapiens (Human)391

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