| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2009 | 15 | Yes |
| 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) | -0.11 | 2.4 | -43.38 | 3 | 3 | 1 | 44 | 206.313 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.11 | 2.72 | -82.66 | 4 | 3 | 2 | 45 | 207.321 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.11 | 4.68 | -103.98 | 4 | 3 | 2 | 45 | 207.321 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0863141A1; US6130232 | IBM Patent Data |
