| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 1st, 2006 | 18 | 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) | -0.93 | 0.17 | -31.02 | 2 | 7 | 0 | 93 | 254.221 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.47 | -0.89 | -58.37 | 1 | 7 | -1 | 96 | 253.213 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0287313A2; EP0287313B1; EP0398230A2; EP0398230B1; EP0464137A1; EP0582157B1; EP0831873A1; EP0852499A1; EP0960216A1; EP0963197A1; EP1017401A2; US5451671; US5495010; US5565437; US6143728; WO1990011081A1; WO1996040191A1; WO1997009052A1; WO1997044492A1; WO19 | IBM Patent Data |
