| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2007 | 31 | 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) | 2.02 | 7.68 | -52.43 | 2 | 7 | 1 | 84 | 428.484 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.44 | 8.32 | -63.1 | 1 | 7 | 1 | 81 | 428.484 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.02 | 7.96 | -112.76 | 3 | 7 | 2 | 85 | 429.492 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 1.44 | 8.6 | -127.5 | 2 | 7 | 2 | 82 | 429.492 | 9 | ↓ |
