| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 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) | 1.85 | 3.78 | -8.07 | 3 | 4 | 0 | 68 | 199.213 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.85 | 3.91 | -30.96 | 4 | 4 | 1 | 69 | 200.221 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.85 | 3.81 | -10.44 | 3 | 4 | 0 | 68 | 199.213 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
