| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2005 | 25 | 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) | 5.43 | 9.83 | -7.75 | 1 | 4 | 0 | 42 | 401.352 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.43 | 10.27 | -28.8 | 2 | 4 | 1 | 43 | 402.36 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 5.43 | 10.11 | -36.93 | 2 | 4 | 1 | 43 | 402.36 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 5.43 | 10.55 | -87.44 | 3 | 4 | 2 | 45 | 403.368 | 5 | ↓ |
