(Z)-N-benzyl-3-[3-bromo-4-[(4-fluorophenyl)methoxy]phenyl]-2-cyanoprop-2-enamide

Formula:C24H18N2O2BrF Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-N-benzyl-3-[3-bromo-4-[(4-fluorophenyl)methoxy]phenyl]-2-cyanoprop-2-enamide is a drug-like molecule.

MolName	(Z)-N-benzyl-3-[3-bromo-4-[(4-fluorophenyl)methoxy]phenyl]-2-cyanoprop-2-enamide
MolecularFormula	C24H18N2O2BrF
Smiles	N#C/C(/C(NCc1ccccc1)=O)=C/c(cc1)cc(Br)c1OCc(cc1)ccc1F
InChI	InChI=1S/C24H18BrFN2O2/c25-22-13-19(8-11-23(22)30-16-18-6-9-21(26)10-7-18)12-20(14-27)24(29)28-15-17-4-2-1-3-5-17/h1-13H,15-16H2,(H,28,29)
InChIK	ZCQBLOLJWTUOLT-UHFFFAOYSA-N
TotalMolweight	465.321
Molweight	465.321
MonoisotopicMass	464.053567
CLogP	4.8718
CLogS	-6.075
H Acceptors	4
H Donors	1
TotalSurfaceArea	330.91
Relative PSA	0.14524
PolarSurfaceArea	62.12
Druglikeness	-4.6462
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.66667
Fragments	1
Non HAtoms	30
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	4
Amides	1
StereoCon

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