In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: 4-methyl-2-oxo-N-(8-quinolyl)-3H-thiazole-5-sulfonamide 4-methyl-2-oxo-N-(8-quinolyl)-3H…
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) | 2.01 | -0.57 | -109.93 | 0 | 6 | -2 | 97 | 319.367 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.01 | -1.35 | -49.9 | 1 | 6 | -1 | 94 | 320.375 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.01 | -0.72 | -46.4 | 1 | 6 | -1 | 95 | 320.375 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.01 | -0.07 | -79.25 | 1 | 6 | -1 | 98 | 320.375 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.55 | 1.55 | -12.89 | 2 | 6 | 0 | 92 | 321.383 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.55 | 2.05 | -35.05 | 2 | 6 | 0 | 95 | 321.383 | 3 | ↓ |