| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 30th, 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 |
|---|---|---|---|---|---|---|---|---|---|---|
| Mid Mid (pH 6-8) | 1.75 | 1.84 | -44.81 | 1 | 2 | -1 | 47 | 138.19 | 0 | ↓ |
| Mid Mid (pH 6-8) | 1.75 | 1.83 | -42.8 | 1 | 2 | -1 | 47 | 138.19 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | WO2000024741A2; WO2000078768A1 | IBM Patent Data |
