(E)-2-(benzenesulfonyl)-3-[5-(4-chlorophenyl)furan-2-yl]-N-(pyridin-3-ylmethyl)prop-2-enamide

Formula:C25H19N2O4ClS Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-2-(benzenesulfonyl)-3-[5-(4-chlorophenyl)furan-2-yl]-N-(pyridin-3-ylmethyl)prop-2-enamide is a drug-like molecule.

MolName	(E)-2-(benzenesulfonyl)-3-[5-(4-chlorophenyl)furan-2-yl]-N-(pyridin-3-ylmethyl)prop-2-enamide
MolecularFormula	C25H19N2O4ClS
Smiles	O=C(/C(/S(c1ccccc1)(=O)=O)=C\c1ccc(-c(cc2)ccc2Cl)o1)NCc1cnccc1
InChI	InChI=1S/C25H19ClN2O4S/c26-20-10-8-19(9-11-20)23-13-12-21(32-23)15-24(33(30,31)22-6-2-1-3-7-22)25(29)28-17-18-5-4-14-27-16-18/h1-16H,17H2,(H,28,29)
InChIK	ZKDYTDWFJAHZKB-UHFFFAOYSA-N
TotalMolweight	478.955
Molweight	478.955
MonoisotopicMass	478.075405
CLogP	3.8034
CLogS	-6.286
H Acceptors	6
H Donors	1
TotalSurfaceArea	352.67
Relative PSA	0.22162
PolarSurfaceArea	97.65
Druglikeness	-2.2889
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51515
Fragments	1
Non HAtoms	33
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	2
Symmetricatoms	5
Amides	1
Aromatic Nitrogens	1
StereoCon

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