| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 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) | 1.74 | 6.12 | -66.9 | 0 | 8 | -1 | 95 | 425.461 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.74 | 8.39 | -79.72 | 1 | 8 | 0 | 96 | 426.469 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.74 | 7.63 | -57.2 | 2 | 8 | 1 | 94 | 427.477 | 7 | ↓ |
