(E)-N-(3,5-dichlorophenyl)-3-(4-nitrophenyl)prop-2-enamide

Formula:C15H10N2O3Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-(3,5-dichlorophenyl)-3-(4-nitrophenyl)prop-2-enamide is a drug-like molecule.

MolName	(E)-N-(3,5-dichlorophenyl)-3-(4-nitrophenyl)prop-2-enamide
MolecularFormula	C15H10N2O3Cl2
Smiles	[O-][N+](c1ccc(/C=C/C(Nc2cc(Cl)cc(Cl)c2)=O)cc1)=O
InChI	InChI=1S/C15H10Cl2N2O3/c16-11-7-12(17)9-13(8-11)18-15(20)6-3-10-1-4-14(5-2-10)19(21)22/h1-9H,(H,18,20)
InChIK	RDPOTUUBGPQCMK-UHFFFAOYSA-N
TotalMolweight	337.161
Molweight	337.161
MonoisotopicMass	336.006847
CLogP	3.4267
CLogS	-5.43
H Acceptors	5
H Donors	1
TotalSurfaceArea	243.24
Relative PSA	0.22579
PolarSurfaceArea	74.92
Druglikeness	-5.4509
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.63636
Fragments	1
Non HAtoms	22
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	5
Amides	1
AcidicOxygens	1
StereoCon

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