| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2009 | 35 | 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) | 6.20 | 11.46 | -15.64 | 2 | 6 | 0 | 93 | 468.505 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.20 | 12.46 | -53.36 | 1 | 6 | -1 | 96 | 467.497 | 8 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0630758A3; EP0630758B1; EP0879855A1; EP0931805A1; US4169089; US4186151; US4189409; US5466655 | IBM Patent Data |
