| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 13th, 2010 | 18 | 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) | 2.86 | 6.27 | -23.02 | 2 | 3 | 1 | 38 | 243.33 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.86 | 5.95 | -9.06 | 1 | 3 | 0 | 36 | 242.322 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0103259A1; EP0113432A1; EP0113432B1; US4544748 | IBM Patent Data |
