In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 24th, 2006 | 21 | Yes |
Popular Name: N-[3-(5,6,8,9-tetrazabicyclo[4.3.0]nona-2,4,7,9-tetraen-4-yl)phenyl]butanamide N-[3-(5,6,8,9-tetrazabicyclo[4.3…
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) | 2.52 | 8.1 | -20.48 | 1 | 6 | 0 | 72 | 281.319 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4654343; US4767765 | IBM Patent Data |