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Name | CHEMBL325742 |
---|---|
Molecular formula | C26H23Cl2N3O4S |
IUPAC name | benzyl N-[2-[2,4-dichloro-N-methyl-3-[(2-methyl-1,3-benzothiazol-4-yl)oxymethyl]anilino]-2-oxoethyl]carbamate |
Molecular weight | 544.447 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 6.1 |
Synonyms | BDBM50074996 SCHEMBL8632906 ({[2,4-Dichloro-3-(2-methyl-benzothiazol-4-yloxymethyl)-phenyl]-methyl-carbamoyl}-methyl)-carbamic acid benzyl ester |
Inchi Key | BVOSSPZCIPMSJY-UHFFFAOYSA-N |
Inchi ID | InChI=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 CID | 15388870 |
ChEMBL | CHEMBL325742 |
IUPHAR | N/A |
BindingDB | 50074996 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
33937 | B2 bradykinin receptor | O70526 | BDKRB2 | Cavia porcellus (Guinea pig) | 372 |
33938 | B2 bradykinin receptor | P30411 | BDKRB2 | Homo sapiens (Human) | 391 |
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