| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 24 | 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) | 5.30 | 12.42 | -10.21 | 1 | 4 | 0 | 43 | 471.129 | 2 | ↓ |
| Mid Mid (pH 6-8) | 5.48 | 13.46 | -33.83 | 2 | 4 | 1 | 48 | 472.137 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 5.48 | 13.05 | -46.16 | 2 | 4 | 1 | 47 | 472.137 | 2 | ↓ |
