| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 22nd, 2008 | 23 | 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) | 3.38 | 6.62 | -45.35 | 0 | 4 | -1 | 56 | 376.205 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.89 | 6.81 | -12.99 | 0 | 4 | 0 | 50 | 377.213 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.89 | 7.09 | -15.16 | 0 | 4 | 0 | 50 | 377.213 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.80 | 6.45 | -15.54 | 0 | 4 | 0 | 50 | 377.213 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | WO2000024741A2 | IBM Patent Data |
