| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2010 | 18 | 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) | 0.50 | 4.29 | -48.94 | 2 | 4 | 1 | 40 | 256.414 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.50 | 5.03 | -38.7 | 2 | 4 | 1 | 37 | 256.414 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.50 | 6.38 | -111.72 | 3 | 4 | 2 | 41 | 257.422 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5618814 | IBM Patent Data |
