In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 21st, 2006 | 26 | No |
None
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) | 3.15 | 7.99 | -17.3 | 2 | 5 | 0 | 92 | 362.466 | 8 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Molecular_Solubility | 7.953 | Bitter DB |
No pre-computed analogs available. Try a structural similarity search.