| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 33 | No |
Popular Name: 3-hydroxy-1-(6-methoxybenzothiazol-2-yl)-4-(4-methylbenzoyl)-5-(3-pyridyl)-5H-pyrrol-2-one 3-hydroxy-1-(6-methoxybenzothiaz…
| 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) | 3.88 | 10.09 | -43.25 | 0 | 7 | -1 | 95 | 456.503 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.32 | 8.69 | -29.39 | 1 | 7 | 0 | 93 | 457.511 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.29 | 9.67 | -21.43 | 0 | 7 | 0 | 89 | 457.511 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.32 | 8.98 | -59.35 | 2 | 7 | 1 | 94 | 458.519 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.29 | 9.96 | -48.63 | 1 | 7 | 1 | 91 | 458.519 | 5 | ↓ |
