| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2007 | 29 | 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) | 3.93 | 4.65 | -15.79 | 3 | 7 | 0 | 99 | 458.312 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.73 | 3.96 | -48.63 | 1 | 7 | -1 | 98 | 457.304 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.93 | 5.42 | -54.27 | 2 | 7 | -1 | 102 | 457.304 | 5 | ↓ |
