| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2009 | 20 | 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) | 3.64 | 5.19 | -37.85 | 2 | 4 | -1 | 81 | 307.391 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.64 | 6.31 | -124.8 | 1 | 4 | -2 | 83 | 306.383 | 11 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 1.09e-01 g/l | DrugBank-experimental |
