| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 20 | 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) | 2.34 | 12.23 | -187.22 | 3 | 3 | 3 | 13 | 280.48 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.34 | 7.19 | -36.95 | 1 | 3 | 1 | 11 | 278.464 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.34 | 9.7 | -101.93 | 2 | 3 | 2 | 12 | 279.472 | 10 | ↓ |
