| BioID | bio199427 |
|---|
| Name | PENEM-2 |
|---|
| ChEMBL ID | CHEMBL1673092 |
|---|
| Molecular Formula | C13H11N3O3S2 |
|---|
| Molecular Weight | 321.38 |
|---|
| Molecular Weight (Monoisotopic) | 321.0242 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
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| Synonyms | None |
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| Smiles | O=C(O)C1=CS[C@@H]2/C(=C\c3cc4n(n3)CSCC4)C(=O)N12 |
|---|
| Inchi | InChI=1S/C13H11N3O3S2/c17-11-9(12-16(11)10(5-21-12)13(18)19)4-7-3-8-1-2-20-6-15(8)14-7/h3-5,12H,1-2,6H2,(H,18,19)/b9-4-/t12-/m1/s1 |
|---|
| Inchi Key | IKNPDLCLBOGEQM-TWLAMCEISA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 5.0 |
|---|
| Bioactivities | 11.0 |
|---|
| Np Likeness Score | -0.56 |
|---|
| Records Key | ['penem 2', 'Penem-2'] |
|---|
| Records Name | ['(R)-6-((5,7-dihydro-4H-pyrazolo[1,5-c][1,3]thiazin-2-yl)methylene)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate', 'Penem-2'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
