| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 11th, 2008 | 20 | 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) | -2.16 | -8.86 | -25.23 | 6 | 11 | 0 | 172 | 284.232 | 2 | ↓ |
| Hi High (pH 8-9.5) | -1.70 | -10.94 | -56.87 | 5 | 11 | -1 | 176 | 283.224 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4347315; US4381344; US4543255; US4728736; US6143443; WO1996035239A1; WO2000075158A2; WO2000078941A2 | IBM Patent Data |
