| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 25th, 2006 | 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) | 3.41 | 9.95 | -58.03 | 0 | 7 | -1 | 96 | 403.414 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.83 | 2.12 | -15.04 | 0 | 7 | 0 | 89 | 404.422 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.41 | 9.14 | -14.76 | 1 | 7 | 0 | 93 | 404.422 | 5 | ↓ |
