| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 19 | 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) | 0.93 | 5.7 | -46.39 | 3 | 3 | 1 | 44 | 292.35 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.93 | 5.38 | -7.64 | 2 | 3 | 0 | 42 | 291.342 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.93 | 6.17 | -97.7 | 4 | 3 | 2 | 45 | 293.358 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
