| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2008 | 36 | 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) | 3.53 | 8.01 | -22.57 | 3 | 8 | 0 | 105 | 482.54 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.08 | 10.3 | -30.26 | 3 | 8 | 0 | 105 | 482.54 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.99 | 7.34 | -55.93 | 2 | 8 | -1 | 108 | 481.532 | 6 | ↓ |
