| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2009 | 31 | Yes |
| 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) | 1.15 | 5.33 | -54.87 | 1 | 8 | 1 | 63 | 444.581 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.15 | 7.68 | -98.31 | 2 | 8 | 2 | 64 | 445.589 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.15 | 5.43 | -43.3 | 1 | 8 | 1 | 63 | 444.581 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.15 | 3.08 | -12.92 | 0 | 8 | 0 | 61 | 443.573 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.15 | 7.69 | -104.85 | 2 | 8 | 2 | 64 | 445.589 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.15 | 5.34 | -54.41 | 1 | 8 | 1 | 63 | 444.581 | 5 | ↓ |
