In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2005 | 20 | 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) | -3.22 | -5.55 | -55.31 | 0 | 9 | -1 | 125 | 299.288 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Therapy | b-lactamase inhibitor | SMDC Pharmakon |
PUBCHEM_PATENT_ID | US4895941 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.