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Name | CHEMBL395387 |
---|---|
Molecular formula | C28H35N3O5S2 |
IUPAC name | butyl N-[3-[4-[[acetyl(pyridin-3-ylmethyl)amino]methyl]phenyl]-5-(2-methylpropyl)thiophen-2-yl]sulfonylcarbamate |
Molecular weight | 557.724 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 5.3 |
Synonyms | BDBM50221301 N-butyloxycarbonyl-3-{4-[N-acetyl-N-(pyridin-3-ylmethyl)-aminomethyl]phenyl}-5-iso-butylthiophene-2-sulfonamide |
Inchi Key | MTAUIEGDCSXXNB-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C28H35N3O5S2/c1-5-6-14-36-28(33)30-38(34,35)27-26(16-25(37-27)15-20(2)3)24-11-9-22(10-12-24)18-31(21(4)32)19-23-8-7-13-29-17-23/h7-13,16-17,20H,5-6,14-15,18-19H2,1-4H3,(H,30,33) |
PubChem CID | 11410359 |
ChEMBL | CHEMBL395387 |
IUPHAR | N/A |
BindingDB | 50221301 |
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 |
---|---|---|---|---|---|
213547 | Type-1A angiotensin II receptor | P25095 | Agtr1 | Rattus norvegicus (Rat) | 359 |
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