| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 11 | 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) | 0.24 | 3.36 | -92.3 | 4 | 2 | 2 | 32 | 154.257 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.24 | 2.95 | -33.57 | 3 | 2 | 1 | 30 | 153.249 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.24 | 0.93 | -43.06 | 3 | 2 | 1 | 31 | 153.249 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
