| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 22 | 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) | 1.29 | 2.1 | -10.72 | 2 | 6 | 0 | 93 | 302.282 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.29 | 3.95 | -91.85 | 0 | 6 | -2 | 99 | 300.266 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.29 | 3.02 | -45.26 | 1 | 6 | -1 | 96 | 301.274 | 5 | ↓ |
