| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 3rd, 2010 | 19 | 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) | -1.58 | -4.43 | -16.05 | 3 | 8 | 0 | 128 | 267.241 | 2 | ↓ |
| Hi High (pH 8-9.5) | -1.12 | -6.9 | -51.87 | 2 | 8 | -1 | 131 | 266.233 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5681940 | IBM Patent Data |
