| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2007 | 34 | No |
Popular Name: 1-benzothiazol-2-yl-3-hydroxy-4-(4-methylbenzoyl)-5-(4-nitrophenyl)-5H-pyrrol-2-one 1-benzothiazol-2-yl-3-hydroxy-4-…
| 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) | 5.04 | 12.95 | -60.89 | 0 | 8 | -1 | 119 | 470.486 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.49 | 11.92 | -35.6 | 1 | 8 | 0 | 116 | 471.494 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.46 | -0.18 | -25.39 | 0 | 8 | 0 | 113 | 471.494 | 5 | ↓ |
