| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2010 | 13 | 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) | -0.70 | 3.39 | -41.55 | 1 | 6 | 0 | 72 | 178.199 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.70 | 2.92 | -35.04 | 0 | 6 | -1 | 71 | 177.191 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.70 | 3.53 | -40.12 | 2 | 6 | 1 | 74 | 179.207 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
