| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 20 | 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) | 3.44 | 7.69 | -31.28 | 3 | 3 | 1 | 43 | 270.4 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.44 | 7.22 | -4.66 | 2 | 3 | 0 | 42 | 269.392 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.44 | 7.9 | -88.57 | 4 | 3 | 2 | 45 | 271.408 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
