In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 31st, 2006 | 16 | Yes |
Popular Name: 8-methyl-9-phenyl-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraene 8-methyl-9-phenyl-1,7-diazabicyc…
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) | 3.20 | 8.97 | -9.51 | 0 | 2 | 0 | 17 | 208.264 | 1 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | US5523318; US5565468; US5597816; WO1993025553A1 | IBM Patent Data |