| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 18th, 2006 | 28 | No |
| 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) | 0.90 | 5.95 | -61.17 | 0 | 7 | -1 | 99 | 394.432 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | -2.46 | -27.27 | 1 | 7 | 0 | 96 | 395.44 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.32 | -2.26 | -19.73 | 0 | 7 | 0 | 93 | 395.44 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.35 | -2.34 | -55.72 | 2 | 7 | 1 | 97 | 396.448 | 4 | ↓ |
