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Name | AVE 0991 |
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Molecular formula | C29H32N4O5S2 |
IUPAC name | 1-ethyl-3-[3-[4-[(5-formyl-4-methoxy-2-phenylimidazol-1-yl)methyl]phenyl]-5-(2-methylpropyl)thiophen-2-yl]sulfonylurea |
Molecular weight | 580.718 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 5.6 |
Synonyms | 2-Thiophenesulfonamide, N-((ethylamino)carbonyl)-3-(4-((5-formyl-4-methoxy-2-phenyl-1H-imidazol-1-yl)methyl)phenyl)-5-(2-methylpropyl)- AB0087841 C29H32N4O5S2 MolPort-019-995-543 3460AH [ Show all ] |
Inchi Key | QTOZBSNPDCWHPV-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H32N4O5S2/c1-5-30-29(35)32-40(36,37)28-24(16-23(39-28)15-19(2)3)21-13-11-20(12-14-21)17-33-25(18-34)27(38-4)31-26(33)22-9-7-6-8-10-22/h6-14,16,18-19H,5,15,17H2,1-4H3,(H2,30,32,35) |
PubChem CID | 9851724 |
ChEMBL | N/A |
IUPHAR | 5579 |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
554694 | Proto-oncogene Mas | P30554 | Mas1 | Mus musculus (Mouse) | 324 |
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