(E)-N-[3-chloro-4-(2-oxochromen-3-yl)phenyl]-3-[5-(2,4-dichlorophenyl)furan-2-yl]prop-2-enamide

Formula:C28H16NO4Cl3 Mutagenic:high Tumorigenic:high Reproductive Effective:high (E)-N-[3-chloro-4-(2-oxochromen-3-yl)phenyl]-3-[5-(2,4-dichlorophenyl)furan-2-yl]prop-2-enamide is not a drug-like molecule.

MolName	(E)-N-[3-chloro-4-(2-oxochromen-3-yl)phenyl]-3-[5-(2,4-dichlorophenyl)furan-2-yl]prop-2-enamide
MolecularFormula	C28H16NO4Cl3
Smiles	O=C(/C=C/c1ccc(-c(ccc(Cl)c2)c2Cl)o1)Nc(cc1)cc(Cl)c1C1=Cc(cccc2)c2OC1=O
InChI	InChI=1S/C28H16Cl3NO4/c29-17-5-9-21(23(30)14-17)26-11-7-19(35-26)8-12-27(33)32-18-6-10-20(24(31)15-18)22-13-16-3-1-2-4-25(16)36-28(22)34/h1-15H,(H,32,33)
InChIK	BAULREATONPTCP-UHFFFAOYSA-N
TotalMolweight	536.797
Molweight	536.797
MonoisotopicMass	535.01449
CLogP	6.9862
CLogS	-8.877
H Acceptors	5
H Donors	1
TotalSurfaceArea	383.16
Relative PSA	0.1609
PolarSurfaceArea	68.54
Druglikeness	1.564
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions
Shape Index	0.61111
Fragments	1
Non HAtoms	36
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	1
Amides	1
StereoCon

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