| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 36 | 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) | 3.43 | 8.84 | -46.05 | 2 | 7 | 1 | 68 | 521.585 | 11 | ↓ |
| Hi High (pH 8-9.5) | 3.43 | 6.3 | -16.64 | 1 | 7 | 0 | 67 | 520.577 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.43 | 11.09 | -107.6 | 3 | 7 | 2 | 69 | 522.593 | 11 | ↓ |
