In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 27 | 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) | 2.66 | 7.35 | -14.48 | 1 | 6 | 0 | 81 | 382.803 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0663914A1; WO1995004736A1 | IBM Patent Data |
PUBCHEM_PATENT_ID | US5677286; US5932709; WO1996034003A1 | IBM Patent Data |