| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 5th, 2006 | 27 | 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) | 4.30 | 10.55 | -13.4 | 1 | 5 | 0 | 63 | 401.297 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.31 | 12.09 | -30.34 | 3 | 5 | 1 | 68 | 402.305 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.30 | 11.04 | -29.58 | 2 | 5 | 1 | 65 | 402.305 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.30 | 10.9 | -35.89 | 2 | 5 | 1 | 65 | 402.305 | 5 | ↓ |
