In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2009 | 24 | Yes |
Popular Name: 4-hydroxy-N-(3-hydroxy-2-pyridyl)-2-methyl-1,1-dioxo-benzo[e]thiazine-3-carboxamide 4-hydroxy-N-(3-hydroxy-2-pyridyl…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.79 | 2.41 | -58.19 | 2 | 8 | -1 | 127 | 346.344 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.79 | 1.66 | -60.76 | 2 | 8 | -1 | 123 | 346.344 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.79 | 2.43 | -119.27 | 1 | 8 | -2 | 125 | 345.336 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.21 | 1.89 | -20.36 | 2 | 8 | 0 | 117 | 347.352 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.21 | 2.71 | -24.32 | 2 | 8 | 0 | 121 | 347.352 | 2 | ↓ |