| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2008 | 28 | 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) | 1.08 | 5.01 | -25.13 | 1 | 8 | 0 | 114 | 419.484 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.90 | 3.48 | -56.53 | 0 | 8 | -1 | 120 | 418.476 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
