(E)-3-[3-bromo-4-[(4-bromophenyl)methoxy]phenyl]-2-cyano-N-phenylprop-2-enamide

Formula:C23H16N2O2Br2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-[3-bromo-4-[(4-bromophenyl)methoxy]phenyl]-2-cyano-N-phenylprop-2-enamide is not a drug-like molecule.

MolName	(E)-3-[3-bromo-4-[(4-bromophenyl)methoxy]phenyl]-2-cyano-N-phenylprop-2-enamide
MolecularFormula	C23H16N2O2Br2
Smiles	N#C/C(/C(Nc1ccccc1)=O)=C\c(cc1)cc(Br)c1OCc(cc1)ccc1Br
InChI	InChI=1S/C23H16Br2N2O2/c24-19-9-6-16(7-10-19)15-29-22-11-8-17(13-21(22)25)12-18(14-26)23(28)27-20-4-2-1-3-5-20/h1-13H,15H2,(H,27,28)
InChIK	KQZFPCDTEJNCLO-UHFFFAOYSA-N
TotalMolweight	512.2
Molweight	512.2
MonoisotopicMass	509.95785
CLogP	5.7868
CLogS	-6.779
H Acceptors	4
H Donors	1
TotalSurfaceArea	329.43
Relative PSA	0.14589
PolarSurfaceArea	62.12
Druglikeness	-3.7736
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.65517
Fragments	1
Non HAtoms	29
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	4
Amides	1
StereoCon

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