| BioID | bio198075 |
|---|
| Name | PHENYLTHIOSEMICARBAZONE |
|---|
| ChEMBL ID | CHEMBL243185 |
|---|
| Molecular Formula | C8H9N3S |
|---|
| Molecular Weight | 179.25 |
|---|
| Molecular Weight (Monoisotopic) | 179.0517 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | (E)-1-Benzylidenethiosemicarbazide|2-Benzylidenehydrazinecarbothioamide|Benzaldehyde N-Allylthiosemicarbazone|Benzaldehyde Thiosemicarbazone|Phenylthiosemicarbazone |
|---|
| Smiles | NC(=S)N/N=C/c1ccccc1 |
|---|
| Inchi | InChI=1S/C8H9N3S/c9-8(12)11-10-6-7-4-2-1-3-5-7/h1-6H,(H3,9,11,12)/b10-6+ |
|---|
| Inchi Key | UYHCMAZIKNVDSX-UXBLZVDNSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 17.0 |
|---|
| Bioactivities | 43.0 |
|---|
| Np Likeness Score | -2.11 |
|---|
| Records Key | ['1a', '6m', 'SID17432648', '5l', 'N1', '2a', '1r', '2a', 'SB1', 'Thio-5', '1'] |
|---|
| Records Name | ['phenylthiosemicarbazone', 'benzaldehyde N-allylthiosemicarbazone', 'SID17432648', 'benzaldehyde thiosemicarbazone', '(E)-1-benzylidenethiosemicarbazide', '2-benzylidenehydrazinecarbothioamide', 'benzaldehyde thiosemicarbazone', '(E)-2-benzylidenehydrazinecarbothioamide', '(2E)-2-Benzylidenehydrazine-1-carbothioamide', '2-benzylidenehydrazinecarbothioamide', 'Benzaldehyde thiosemicarbazone'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
