| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 5th, 2009 | 22 | 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) | 2.49 | 7.45 | -31.85 | 3 | 5 | 1 | 60 | 309.478 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.49 | 8.45 | -105.1 | 4 | 5 | 2 | 65 | 310.486 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.49 | 6.89 | -11.6 | 2 | 5 | 0 | 59 | 308.47 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.49 | 7.59 | -39.55 | 3 | 5 | 1 | 64 | 309.478 | 7 | ↓ |
