| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2010 | 16 | 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) | 1.05 | 6.08 | -33.2 | 1 | 4 | 1 | 44 | 223.296 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.05 | 4.17 | -6.15 | 0 | 4 | 0 | 42 | 222.288 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
