(E)-3-(furan-2-yl)-N-[4-[4-(2,3,4,5,6-pentafluorophenyl)piperazin-1-yl]phenyl]prop-2-enamide

Formula:C23H18N3O2F5 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-3-(furan-2-yl)-N-[4-[4-(2,3,4,5,6-pentafluorophenyl)piperazin-1-yl]phenyl]prop-2-enamide is a drug-like molecule.

MolName	(E)-3-(furan-2-yl)-N-[4-[4-(2,3,4,5,6-pentafluorophenyl)piperazin-1-yl]phenyl]prop-2-enamide
MolecularFormula	C23H18N3O2F5
Smiles	O=C(/C=C/c1ccco1)Nc(cc1)ccc1N(CC1)CCN1c(c(F)c(c(F)c1F)F)c1F
InChI	InChI=1S/C23H18F5N3O2/c24-18-19(25)21(27)23(22(28)20(18)26)31-11-9-30(10-12-31)15-5-3-14(4-6-15)29-17(32)8-7-16-2-1-13-33-16/h1-8,13H,9-12H2,(H,29,32)
InChIK	JCGSDONBMPIRNT-UHFFFAOYSA-N
TotalMolweight	463.405
Molweight	463.405
MonoisotopicMass	463.131917
CLogP	4.1026
CLogS	-6.2
H Acceptors	5
H Donors	1
TotalSurfaceArea	332.07
Relative PSA	0.13765
PolarSurfaceArea	48.72
Druglikeness	2.3456
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	polyhalo aromatic ring
Shape Index	0.60606
Fragments	1
Non HAtoms	33
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	5
Symmetricatoms	8
Amides	1
Amines	2
Aromatic Amines	2
StereoCon

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