| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 13 | 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 |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.86 | 2.88 | -46.64 | 1 | 5 | -1 | 89 | 180.139 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.74 | 3.46 | -15.45 | 1 | 5 | 0 | 83 | 181.147 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0369627A2; EP0369627B1; US5008267 | IBM Patent Data |
