| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 2007 | 38 | No |
| 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) | 4.05 | 10.23 | -65.7 | 0 | 8 | -1 | 90 | 515.634 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.50 | 13.12 | -46.23 | 2 | 8 | 1 | 89 | 517.65 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.50 | 13.54 | -91.44 | 3 | 8 | 2 | 90 | 518.658 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.05 | 12.56 | -78.4 | 1 | 8 | 0 | 91 | 516.642 | 8 | ↓ |
