| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 25 | No |
| 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) | 1.39 | 7.64 | -10.8 | 0 | 6 | 0 | 61 | 347.459 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.39 | 8.9 | -47.74 | 1 | 6 | 1 | 62 | 348.467 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.39 | 8.99 | -47.9 | 1 | 6 | 1 | 62 | 348.467 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
