| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 30 | No |
None
None
| 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) | 3.50 | 8.87 | -39.47 | 2 | 5 | 1 | 51 | 404.534 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.50 | 6.59 | -9.25 | 1 | 5 | 0 | 50 | 403.526 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.50 | 10.62 | -113.12 | 3 | 5 | 2 | 53 | 405.542 | 5 | ↓ |
