| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 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) | 0.69 | 1.52 | -47.03 | 5 | 4 | 1 | 80 | 190.226 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.69 | 1.18 | -6.63 | 4 | 4 | 0 | 78 | 189.218 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.69 | 1.99 | -101.35 | 6 | 4 | 2 | 81 | 191.234 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
