| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 8th, 2011 | 15 | Yes |
None
| 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) | 1.61 | 2.44 | -32.8 | 3 | 3 | 1 | 37 | 213.345 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.61 | 3.51 | -108.11 | 4 | 3 | 2 | 41 | 214.353 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4254135 | IBM Patent Data |
