(E)-3-(2,4-dichlorophenyl)-N-[2-[4-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]piperazin-1-yl]ethyl]prop-2-enamide

Formula:C24H23N3O2Cl4 Mutagenic:none Tumorigenic:none Reproductive Effective:low (E)-3-(2,4-dichlorophenyl)-N-[2-[4-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]piperazin-1-yl]ethyl]prop-2-enamide is not a drug-like molecule.

MolName	(E)-3-(2,4-dichlorophenyl)-N-[2-[4-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]piperazin-1-yl]ethyl]prop-2-enamide
MolecularFormula	C24H23N3O2Cl4
Smiles	O=C(/C=C/c(ccc(Cl)c1)c1Cl)NCCN(CC1)CCN1C(/C=C/c(ccc(Cl)c1)c1Cl)=O
InChI	InChI=1S/C24H23Cl4N3O2/c25-19-5-1-17(21(27)15-19)3-7-23(32)29-9-10-30-11-13-31(14-12-30)24(33)8-4-18-2-6-20(26)16-22(18)28/h1-8,15-16H,9-14H2,(H,29,32)
InChIK	YJAAWOLVSQRRKM-UHFFFAOYSA-N
TotalMolweight	527.278
Molweight	527.278
MonoisotopicMass	525.054435
CLogP	5.4595
CLogS	-5.749
H Acceptors	5
H Donors	1
TotalSurfaceArea	384.32
Relative PSA	0.11615
PolarSurfaceArea	52.65
Druglikeness	6.9246
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.69697
Fragments	1
Non HAtoms	33
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	7
Symmetricatoms	2
Amides	2
Amines	1
AlkylAmines	1
BasicNitrogens	1
StereoCon

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1 - (E)-3-(2,4-dichlorophenyl)-N-[2-[4-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]piperazin-1-yl]ethyl]prop-2-enamide | 2 - (E)-3-(2,4-dichlorophenyl)-N-[2-[4-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]piperazin-1-yl]ethyl]prop-2-enamide

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