| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 26 | 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) | 3.02 | 6.63 | -52.5 | 1 | 5 | 1 | 45 | 372.514 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.02 | 4.36 | -13.28 | 0 | 5 | 0 | 44 | 371.506 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.02 | 6.63 | -62.88 | 1 | 5 | 1 | 45 | 372.514 | 4 | ↓ |
