| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 9th, 2011 | 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) | 3.15 | 5.28 | -5.76 | 3 | 4 | 0 | 53 | 401.551 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.15 | 6.69 | -41.17 | 4 | 4 | 1 | 54 | 402.559 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.15 | 7.53 | -43.53 | 4 | 4 | 1 | 54 | 402.559 | 4 | ↓ |
