| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 18 | 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) | 1.08 | 7.34 | -37.65 | 2 | 5 | 1 | 57 | 240.29 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.08 | 6.89 | -10.91 | 1 | 5 | 0 | 56 | 239.282 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.08 | 7.8 | -79.39 | 3 | 5 | 2 | 58 | 241.298 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
