| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 30th, 2009 | 34 | 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) | 3.05 | 10.34 | -62.01 | 1 | 9 | -1 | 113 | 494.927 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.05 | 8.32 | -13.58 | 2 | 9 | 0 | 110 | 495.935 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4990517; US5059597; US5416096; US5607942 | IBM Patent Data |
