| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 18th, 2007 | 30 | 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) | 3.71 | 8.84 | -57.64 | 0 | 6 | -1 | 79 | 428.53 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.16 | 8.16 | -13.08 | 1 | 6 | 0 | 76 | 429.538 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.13 | -0.95 | -13.17 | 0 | 6 | 0 | 72 | 429.538 | 10 | ↓ |
