| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 10 | 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) | -2.59 | 0.42 | -39.41 | 3 | 5 | 0 | 88 | 146.146 | 4 | ↓ |
| Hi High (pH 8-9.5) | -2.59 | -1.78 | -51.53 | 2 | 5 | -1 | 86 | 145.138 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4199444; US4266035; US4288545; US4317885; US4350770; US4444888; US4482632; US4483923 | IBM Patent Data |
