| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2011 | 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) | 0.59 | -1.1 | -12.4 | 1 | 7 | 0 | 97 | 296.304 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.74 | -3.73 | -46.81 | 0 | 7 | -1 | 100 | 295.296 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
