| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2011 | 10 | 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) | 1.87 | 4.83 | -37.92 | 2 | 1 | 1 | 17 | 158.29 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.87 | 3.14 | -1.34 | 1 | 1 | 0 | 12 | 157.282 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
