| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 10th, 2011 | 25 | 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) | 0.99 | 3.08 | -10.25 | 4 | 6 | 0 | 95 | 342.374 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.99 | 3.38 | -50.67 | 5 | 6 | 1 | 97 | 343.382 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.99 | 4.2 | -105.16 | 6 | 6 | 2 | 98 | 344.39 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
