| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 29 | 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) | 3.12 | 10.51 | -46.04 | 2 | 5 | 1 | 59 | 416.542 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.12 | 8.27 | -12.74 | 1 | 5 | 0 | 58 | 415.534 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.12 | 10.91 | -96.24 | 3 | 5 | 2 | 60 | 417.55 | 5 | ↓ |
