| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2008 | 31 | 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) | 3.34 | 10.09 | -16.47 | 3 | 7 | 0 | 92 | 421.476 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.51 | 10.68 | -44.49 | 4 | 7 | 1 | 97 | 422.484 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.51 | 10.26 | -44.57 | 2 | 7 | -1 | 94 | 420.468 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.51 | 10.72 | -17.62 | 3 | 7 | 0 | 95 | 421.476 | 6 | ↓ |
