| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2009 | 15 | No |
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) | 2.50 | 6.55 | -46.7 | 1 | 3 | -1 | 56 | 238.675 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.06 | 6.27 | -108.47 | 0 | 3 | -2 | 53 | 237.667 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0486586A1; EP0486586B1; US5250541 | IBM Patent Data |
