| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 17 | 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) | 0.17 | 2.08 | -53.18 | 2 | 7 | -1 | 119 | 232.175 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.63 | -0.95 | -122.57 | 1 | 7 | -2 | 122 | 231.167 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.04 | 4.84 | -98.43 | 3 | 7 | 0 | 120 | 233.183 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
