| BioID | bio199418 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL1762590 |
|---|
| Molecular Formula | C24H18N2O4S |
|---|
| Molecular Weight | 430.49 |
|---|
| Molecular Weight (Monoisotopic) | 430.0987 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 10-(2-Thienyl)Camptothecin |
|---|
| Smiles | CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3cc(-c4cccs4)ccc3nc2-1 |
|---|
| Inchi | InChI=1S/C24H18N2O4S/c1-2-24(29)17-10-19-21-15(11-26(19)22(27)16(17)12-30-23(24)28)9-14-8-13(5-6-18(14)25-21)20-4-3-7-31-20/h3-10,29H,2,11-12H2,1H3/t24-/m0/s1 |
|---|
| Inchi Key | YXHIWWIOODGLAP-DEOSSOPVSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 3.0 |
|---|
| Np Likeness Score | 0.37 |
|---|
| Records Key | ['27'] |
|---|
| Records Name | ['10-(2-thienyl)camptothecin'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
