(E)-3-phenyl-N-[8-[[(E)-3-phenylprop-2-enoyl]amino]octyl]prop-2-enamide

Formula:C26H32N2O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-phenyl-N-[8-[[(E)-3-phenylprop-2-enoyl]amino]octyl]prop-2-enamide is not a drug-like molecule.

MolName(E)-3-phenyl-N-[8-[[(E)-3-phenylprop-2-enoyl]amino]octyl]prop-2-enamide
MolecularFormulaC26H32N2O2
SmilesO=C(/C=C/c1ccccc1)NCCCCCCCCNC(/C=C/c1ccccc1)=O
InChIInChI=1S/C26H32N2O2/c29-25(19-17-23-13-7-5-8-14-23)27-21-11-3-1-2-4-12-22-28-26(30)20-18-24-15-9-6-10-16-24/h5-10,13-20H,1-4,11-12,21-22H2,(H,27,29)(H,28,30)
InChIKZCCQDLOCHSARDX-UHFFFAOYSA-N
TotalMolweight404.552
Molweight404.552
MonoisotopicMass404.246378
CLogP5.417
CLogS-5.218
H Acceptors4
H Donors2
TotalSurfaceArea354.52
Relative PSA0.13822
PolarSurfaceArea58.2
Druglikeness-6.2211
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.8
Fragments1
Non HAtoms30
NonCHAtoms4
Electronegative Atoms4
Rotatable Bond13
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms8
Symmetricatoms17
Amides2
StereoCon

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