[2-(3,5-dichloroanilino)-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate

Formula:C15H11NO4Cl2 Mutagenic:high Tumorigenic:none Reproductive Effective:none [2-(3,5-dichloroanilino)-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate is a drug-like molecule.

MolName	[2-(3,5-dichloroanilino)-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate
MolecularFormula	C15H11NO4Cl2
Smiles	O=C(COC(/C=C/c1ccco1)=O)Nc1cc(Cl)cc(Cl)c1
InChI	InChI=1S/C15H11Cl2NO4/c16-10-6-11(17)8-12(7-10)18-14(19)9-22-15(20)4-3-13-2-1-5-21-13/h1-8H,9H2,(H,18,19)
InChIK	HODMQPQHDPUGMV-UHFFFAOYSA-N
TotalMolweight	340.161
Molweight	340.161
MonoisotopicMass	339.006513
CLogP	3.0949
CLogS	-4.555
H Acceptors	5
H Donors	1
TotalSurfaceArea	250.77
Relative PSA	0.24584
PolarSurfaceArea	68.54
Druglikeness	0.25997
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.63636
Fragments	1
Non HAtoms	22
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	2
Symmetricatoms	3
Amides	1
StereoCon

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