| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 17th, 2009 | 30 | No |
| 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) | 4.41 | 12.44 | -15.55 | 1 | 4 | 0 | 62 | 400.522 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.99 | 12.24 | -51.56 | 1 | 4 | -1 | 68 | 399.514 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.41 | 11.65 | -21.66 | 1 | 4 | 0 | 62 | 400.522 | 5 | ↓ |
