| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 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) | 4.50 | 8.5 | -52.29 | 0 | 3 | -1 | 41 | 328.189 | 2 | ↓ |
| Mid Mid (pH 6-8) | 4.50 | 7.74 | -10.23 | 1 | 3 | 0 | 38 | 329.197 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 4.50 | 8.2 | -22.98 | 2 | 3 | 1 | 39 | 330.205 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
