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Name | CHEMBL344464 |
---|---|
Molecular formula | C29H29ClN4O5S |
IUPAC name | 2-[[2-butyl-3-[[4-[(2-chlorophenyl)sulfonylcarbamoyl]phenyl]methyl]imidazol-4-yl]methylamino]benzoic acid |
Molecular weight | 581.084 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 3 |
XlogP | 6.0 |
Synonyms | 2-[[[1-[4-[[[(2-Chlorophenyl)sulfonyl]amino]carbonyl]benzyl]-2-butyl-1H-imidazole-5-yl]methyl]amino]benzoic acid BDBM50082567 L009542 2-{2-butyl-1-[4-(2-chlorophenylsulfonamidocarbonyl)benzyl]-1H-5-imidazolylmethylamino}benzoic acid 2-({2-Butyl-3-[4-(2-chloro-benzenesulfonylaminocarbonyl)-benzyl]-3H-imidazol-4-ylmethyl}-amino)-benzoic acid |
Inchi Key | FFFCMSOLUADUNO-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H29ClN4O5S/c1-2-3-12-27-32-18-22(17-31-25-10-6-4-8-23(25)29(36)37)34(27)19-20-13-15-21(16-14-20)28(35)33-40(38,39)26-11-7-5-9-24(26)30/h4-11,13-16,18,31H,2-3,12,17,19H2,1H3,(H,33,35)(H,36,37) |
PubChem CID | 10745817 |
ChEMBL | CHEMBL344464 |
IUPHAR | N/A |
BindingDB | 50082567 |
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 |
---|---|---|---|---|---|
76996 | Type-1A angiotensin II receptor | P25095 | Agtr1 | Rattus norvegicus (Rat) | 359 |
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