| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 21st, 2014 | 43 | 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) | 2.08 | 7.49 | -17.1 | 3 | 10 | 0 | 118 | 581.673 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.08 | 8.12 | -49.11 | 2 | 10 | -1 | 121 | 580.665 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.