| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 16th, 2007 | 35 | No |
Popular Name: 1-(6-ethoxybenzothiazol-2-yl)-3-hydroxy-4-(4-methoxybenzoyl)-5-(3-pyridyl)-5H-pyrrol-2-one 1-(6-ethoxybenzothiazol-2-yl)-3-…
| 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) | 3.86 | 9.67 | -42.14 | 0 | 8 | -1 | 105 | 486.529 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.31 | -2.08 | -29.93 | 1 | 8 | 0 | 101 | 487.537 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.28 | -1.86 | -20.17 | 0 | 8 | 0 | 98 | 487.537 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.31 | -1.96 | -60.76 | 2 | 8 | 1 | 103 | 488.545 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.28 | -1.75 | -50.43 | 1 | 8 | 1 | 100 | 488.545 | 7 | ↓ |
