| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 31 | 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) | 0.57 | 3.17 | -64.22 | 4 | 13 | -1 | 195 | 450.324 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.57 | 3.42 | -72.95 | 5 | 13 | 0 | 196 | 451.332 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.57 | -0.98 | -70.1 | 5 | 13 | 0 | 196 | 451.332 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.