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| Ligand Name: 8-nitro-2-(piperidin-1-yl)-6-(trifluoromethyl)-4H-1,3-benzothiazin-4-one |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB823 |
PubChem:
67149102
|
Synonym(s):
- schembl1752706
- chembl2419032
- 8-nitro-2-(1-piperidyl)-6-(trifluoromethyl)-1,3-benzothiazin-4-one
- 8-nitro-2-piperidin-1-yl-6-(trifluoromethyl)-1,3-benzothiazin-4-one
show 3 synonym(s)
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| DrugBank: - |
ChEMBL: CHEMBL2419032 |
| Canonical SMILES: [O-][N+](=O)c1cc(C(F)(F)F)cc(c12)c(=O)nc(s2)N3CCCCC3 |
| Standard InChI: InChI=1S/C14H12F3N3O3S/c15-14(16,17)8-6-9-11(10(7-8)20(22)23)24-13(18-12(9)21)19-4-2-1-3-5-19/h6-7H,1-5H2 |
| Molecular Formula: C14H12F3N3O3S |
Mol. Weight: 359.05515 |
logP: 3.5738 |
| HBD: 0 | HBA: 6 |
| #Rotatable Bonds: 2 | TPSA: 76.34 |