| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 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) | 3.32 | 6.67 | -31.45 | 3 | 3 | 1 | 51 | 240.33 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.19 | 6.92 | -7.67 | 2 | 3 | 0 | 51 | 239.322 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.32 | 7.14 | -85.2 | 4 | 3 | 2 | 52 | 241.338 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
