(E)-3-(4-bromophenyl)-N-[[3-[[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]methyl]phenyl]methyl]prop-2-enamide

Formula:C26H22N2O2Br2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(4-bromophenyl)-N-[[3-[[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]methyl]phenyl]methyl]prop-2-enamide is not a drug-like molecule.

MolName	(E)-3-(4-bromophenyl)-N-[[3-[[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]methyl]phenyl]methyl]prop-2-enamide
MolecularFormula	C26H22N2O2Br2
Smiles	O=C(/C=C/c(cc1)ccc1Br)NCc1cccc(CNC(/C=C/c(cc2)ccc2Br)=O)c1
InChI	InChI=1S/C26H22Br2N2O2/c27-23-10-4-19(5-11-23)8-14-25(31)29-17-21-2-1-3-22(16-21)18-30-26(32)15-9-20-6-12-24(28)13-7-20/h1-16H,17-18H2,(H,29,31)(H,30,32)
InChIK	JEXDESRTUASPCG-UHFFFAOYSA-N
TotalMolweight	554.281
Molweight	554.281
MonoisotopicMass	552.0048
CLogP	5.4822
CLogS	-6.68
H Acceptors	4
H Donors	2
TotalSurfaceArea	368.98
Relative PSA	0.1328
PolarSurfaceArea	58.2
Druglikeness	-1.6982
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.71875
Fragments	1
Non HAtoms	32
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	17
Amides	2
StereoCon

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1 - (E)-3-(4-bromophenyl)-N-[[3-[[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]methyl]phenyl]methyl]prop-2-enamide | 2 - (E)-3-(4-bromophenyl)-N-[[3-[[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]methyl]phenyl]methyl]prop-2-enamide

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