(E)-3-[3-bromo-4-[(2-cyanophenyl)methoxy]phenyl]-2-cyano-N-(4-fluorophenyl)prop-2-enamide

Formula:C24H15N3O2BrF Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-[3-bromo-4-[(2-cyanophenyl)methoxy]phenyl]-2-cyano-N-(4-fluorophenyl)prop-2-enamide is a drug-like molecule.

MolName	(E)-3-[3-bromo-4-[(2-cyanophenyl)methoxy]phenyl]-2-cyano-N-(4-fluorophenyl)prop-2-enamide
MolecularFormula	C24H15N3O2BrF
Smiles	N#C/C(/C(Nc(cc1)ccc1F)=O)=C\c(cc1)cc(Br)c1OCc(cccc1)c1C#N
InChI	InChI=1S/C24H15BrFN3O2/c25-22-12-16(5-10-23(22)31-15-18-4-2-1-3-17(18)13-27)11-19(14-28)24(30)29-21-8-6-20(26)7-9-21/h1-12H,15H2,(H,29,30)
InChIK	IVIAJMWVECYCLV-UHFFFAOYSA-N
TotalMolweight	476.304
Molweight	476.304
MonoisotopicMass	475.033166
CLogP	4.998
CLogS	-7.032
H Acceptors	5
H Donors	1
TotalSurfaceArea	338.86
Relative PSA	0.18185
PolarSurfaceArea	85.91
Druglikeness	-5.1136
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.6129
Fragments	1
Non HAtoms	31
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	2
Amides	1
StereoCon

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