In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 30th, 2010 | 30 | 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) | 3.31 | 11.44 | -12.9 | 0 | 8 | 0 | 101 | 422.474 | 11 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0440494A3; EP1059930A1; US5078750; US5506268; US5763494; WO1994028888A1; WO1997039355A1; WO1998008498A1; WO1999021006A1; WO1999044623A1; WO2000051586A2 | IBM Patent Data |