| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 2010 | 13 | 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) | 1.47 | 3.15 | -8.6 | 1 | 3 | 0 | 46 | 192.14 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.93 | 0.84 | -38.43 | 0 | 3 | -1 | 49 | 191.132 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0958296A1; US5985884; WO1997041097A2 | IBM Patent Data |
