| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2010 | 16 | 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) | 2.97 | 8.2 | -40.19 | 1 | 2 | 1 | 8 | 223.315 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.97 | 5.98 | -3.34 | 0 | 2 | 0 | 6 | 222.307 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0186310A1; EP0233728A1; US4640916; US4789675 | IBM Patent Data |
