| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 28th, 2004 | 27 | 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) | 2.35 | 10.39 | -24.12 | 1 | 7 | 0 | 81 | 361.405 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.35 | 11.23 | -51.02 | 3 | 7 | 1 | 86 | 362.413 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.35 | 10.72 | -44.43 | 2 | 7 | 1 | 83 | 362.413 | 4 | ↓ |
