| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 29th, 2006 | 28 | 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) | 2.96 | 7.73 | -16.66 | 1 | 7 | 0 | 82 | 398.488 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.96 | 8.76 | -40.76 | 3 | 7 | 1 | 86 | 399.496 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.96 | 8.14 | -34.58 | 2 | 7 | 1 | 83 | 399.496 | 7 | ↓ |
