| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 2nd, 2010 | 16 | 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) | 2.13 | 5.16 | -64.35 | 0 | 4 | -1 | 62 | 218.232 | 0 | ↓ |
| Mid Mid (pH 6-8) | 2.13 | 4.03 | -9.86 | 1 | 4 | 0 | 59 | 219.24 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0511600A2; EP0511600A3; EP0511600B1; US5336782; US5414089; USRE36359 | IBM Patent Data |
