| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2009 | 31 | 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) | 3.57 | 14.94 | -44.69 | 1 | 7 | 1 | 57 | 427.617 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | 12.59 | -11.18 | 0 | 7 | 0 | 56 | 426.609 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.57 | 15.28 | -94.43 | 2 | 7 | 2 | 58 | 428.625 | 3 | ↓ |
