| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 19th, 2010 | 30 | 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) | 2.19 | 8.11 | -53.62 | 2 | 7 | 1 | 70 | 448.638 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.01 | 4.95 | -47.29 | 0 | 7 | -1 | 75 | 446.622 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.75 | 5.26 | -11.26 | 1 | 7 | 0 | 72 | 447.63 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 7.24 | -43.29 | 1 | 7 | 0 | 76 | 447.63 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 7.22 | -63.39 | 1 | 7 | 0 | 76 | 447.63 | 7 | ↓ |
