| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 13 | 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) | -0.73 | -2.66 | -59.25 | 5 | 4 | 1 | 77 | 184.215 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.73 | -3.03 | -11.17 | 4 | 4 | 0 | 76 | 183.207 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0654534A2; EP0654534A3; EP0654534B1; EP0924193A1; EP0924194A2; EP0939134A1; US5629200; US5811293; US6114582 | IBM Patent Data |
