| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 9th, 2006 | 14 | 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) | 1.25 | 5.11 | -50.4 | 1 | 3 | -1 | 60 | 191.206 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.25 | 3.15 | -7.6 | 2 | 3 | 0 | 58 | 192.214 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5942644 | IBM Patent Data |
