In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2009 | 26 | Yes |
Popular Name: (8E)-8-benzylidene-2-oxo-4-phenyl-1,5,6,7-tetrahydroquinoline-3-carbonitrile (8E)-8-benzylidene-2-oxo-4-pheny…
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) | 5.07 | 11.59 | -14.66 | 1 | 3 | 0 | 57 | 338.41 | 2 | ↓ |
Hi High (pH 8-9.5) | 5.53 | 9.72 | -52.89 | 0 | 3 | -1 | 60 | 337.402 | 2 | ↓ |