| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 17th, 2010 | 10 | No |
| 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) | -0.75 | -2.28 | -11.35 | 2 | 4 | 0 | 63 | 164.23 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.75 | -2.45 | -55.68 | 3 | 4 | 1 | 65 | 165.238 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0059356A1; US4436743; US4551454 | IBM Patent Data |
