| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 11 | 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) | -1.40 | 0.05 | -41.9 | 5 | 5 | 1 | 72 | 161.229 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -1.40 | -0.11 | -105.62 | 6 | 5 | 2 | 73 | 162.237 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0355279A2; US4942170; US5145975 | IBM Patent Data |
