| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 2010 | 15 | 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) | 1.86 | 4.53 | -31.59 | 3 | 4 | 0 | 80 | 222.631 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.86 | 4.12 | -43.42 | 2 | 4 | -1 | 79 | 221.623 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.