| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 1st, 2010 | 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) | 2.58 | 5.45 | -17.74 | 2 | 6 | 0 | 93 | 434.504 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.58 | 6.2 | -59.58 | 1 | 6 | -1 | 96 | 433.496 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.