| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2009 | 33 | 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) | 3.15 | 15.32 | -46.92 | 1 | 7 | 1 | 57 | 453.586 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.15 | 12.97 | -15.17 | 0 | 7 | 0 | 56 | 452.578 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.15 | 15.61 | -98.52 | 2 | 7 | 2 | 58 | 454.594 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.15 | 15.59 | -98.87 | 2 | 7 | 2 | 58 | 454.594 | 3 | ↓ |
