| BioID | bio1706 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL259804 |
|---|
| Molecular Formula | C16H13N3O3S |
|---|
| Molecular Weight | 327.37 |
|---|
| Molecular Weight (Monoisotopic) | 327.0678 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | C-5142087 |
|---|
| Smiles | O=c1[nH]c(-c2cccc([N+](=O)[O-])c2)nc2sc3c(c12)CCCC3 |
|---|
| Inchi | InChI=1S/C16H13N3O3S/c20-15-13-11-6-1-2-7-12(11)23-16(13)18-14(17-15)9-4-3-5-10(8-9)19(21)22/h3-5,8H,1-2,6-7H2,(H,17,18,20) |
|---|
| Inchi Key | PGKKSSRLXTZLGF-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 7.0 |
|---|
| Bioactivities | 7.0 |
|---|
| Np Likeness Score | -2.17 |
|---|
| Records Key | ['10, C-5142087', '6e'] |
|---|
| Records Name | ['2-(3-Nitro-phenyl)-5,6,7,8-tetrahydro-3H-benzo[4,5]thieno[2,3-d]pyrimidin-4-one', '2-(3-nitrophenyl)-5,6,7,8-tetrahydrobenzothieno[2,3-d]pyrimidin-4(3H)-one'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
