In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2004 | 25 | No |
None
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) | -1.39 | 2.65 | -34.59 | 1 | 4 | 1 | 46 | 340.443 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0052074A2; EP0403048A2; EP1054998A1; US3102845; US4207890; WO1997044063A2; WO1998011888A1; WO1999030690A1; WO1999036570A2 | IBM Patent Data |