| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 15th, 2007 | 32 | 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) | 2.19 | 4.2 | -16.16 | 3 | 8 | 0 | 112 | 428.448 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.19 | 4.96 | -54.12 | 2 | 8 | -1 | 114 | 427.44 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.98 | 6.45 | -42.71 | 4 | 8 | 1 | 113 | 429.456 | 4 | ↓ |
