| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 14 | 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) | 1.05 | 2.86 | -85.18 | 3 | 3 | 2 | 24 | 199.342 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.05 | -0.95 | -1.3 | 1 | 3 | 0 | 19 | 197.326 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.05 | 1.17 | -29.74 | 2 | 3 | 1 | 20 | 198.334 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
