| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2008 | 29 | 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) | 3.61 | 10.46 | -13.7 | 1 | 6 | 0 | 79 | 409.511 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.43 | 9.39 | -50.52 | 0 | 6 | -1 | 86 | 408.503 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
