| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 27 | 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) | 1.66 | 8.57 | -78.37 | 6 | 8 | 2 | 114 | 376.505 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.66 | 6.41 | -14.4 | 4 | 8 | 0 | 111 | 374.489 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.66 | 6.35 | -35.44 | 5 | 8 | 1 | 113 | 375.497 | 4 | ↓ |
