| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2009 | 15 | 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) | 2.42 | 6.56 | -36.48 | 1 | 2 | 1 | 8 | 209.288 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.42 | 4.2 | -3.96 | 0 | 2 | 0 | 6 | 208.28 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0316668A2; US4950648 | IBM Patent Data |
