| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 26th, 2009 | 20 | 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) | 3.27 | 7.37 | -45.61 | 2 | 3 | 1 | 37 | 271.384 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.27 | 5.39 | -8.38 | 1 | 3 | 0 | 36 | 270.376 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5177082 | IBM Patent Data |
