| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 28 | No |
None
None
| 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) | 3.81 | 9.75 | -42.24 | 2 | 5 | 1 | 58 | 379.48 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.81 | 10.49 | -30.08 | 1 | 5 | 0 | 61 | 378.472 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.81 | 10.49 | -102.5 | 3 | 5 | 0 | 59 | 380.488 | 4 | ↓ |
