(E)-2-cyano-3-[3-[(E)-2-cyano-3-(cyclohexylamino)-3-oxoprop-1-enyl]phenyl]-N-cyclohexylprop-2-enamide

Formula:C26H30N4O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-2-cyano-3-[3-[(E)-2-cyano-3-(cyclohexylamino)-3-oxoprop-1-enyl]phenyl]-N-cyclohexylprop-2-enamide is a drug-like molecule.

MolName	(E)-2-cyano-3-[3-[(E)-2-cyano-3-(cyclohexylamino)-3-oxoprop-1-enyl]phenyl]-N-cyclohexylprop-2-enamide
MolecularFormula	C26H30N4O2
Smiles	N#C/C(/C(NC1CCCCC1)=O)=C\c1cccc(/C=C(/C(NC2CCCCC2)=O)\C#N)c1
InChI	InChI=1S/C26H30N4O2/c27-17-21(25(31)29-23-10-3-1-4-11-23)15-19-8-7-9-20(14-19)16-22(18-28)26(32)30-24-12-5-2-6-13-24/h7-9,14-16,23-24H,1-6,10-13H2,(H,29,31)(H,30,32)
InChIK	WVASRNVCXPXOAG-UHFFFAOYSA-N
TotalMolweight	430.55
Molweight	430.55
MonoisotopicMass	430.236876
CLogP	4.011
CLogS	-6.058
H Acceptors	6
H Donors	2
TotalSurfaceArea	360.12
Relative PSA	0.21137
PolarSurfaceArea	105.78
Druglikeness	-5.8368
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.59375
Fragments	1
Non HAtoms	32
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	12
Symmetricatoms	17
Amides	2
StereoCon

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1 - (E)-2-cyano-3-[3-[(E)-2-cyano-3-(cyclohexylamino)-3-oxoprop-1-enyl]phenyl]-N-cyclohexylprop-2-enamide | 2 - (E)-2-cyano-3-[3-[(E)-2-cyano-3-(cyclohexylamino)-3-oxoprop-1-enyl]phenyl]-N-cyclohexylprop-2-enamide

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