[2-(furan-2-ylmethylamino)-2-oxoethyl] (E)-3-(2,4-dichlorophenyl)prop-2-enoate

Formula:C16H13NO4Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-(furan-2-ylmethylamino)-2-oxoethyl] (E)-3-(2,4-dichlorophenyl)prop-2-enoate is a drug-like molecule.

MolName	[2-(furan-2-ylmethylamino)-2-oxoethyl] (E)-3-(2,4-dichlorophenyl)prop-2-enoate
MolecularFormula	C16H13NO4Cl2
Smiles	O=C(COC(/C=C/c(ccc(Cl)c1)c1Cl)=O)NCc1ccco1
InChI	InChI=1S/C16H13Cl2NO4/c17-12-5-3-11(14(18)8-12)4-6-16(21)23-10-15(20)19-9-13-2-1-7-22-13/h1-8H,9-10H2,(H,19,20)
InChIK	IMVWPHDOHYYBQU-UHFFFAOYSA-N
TotalMolweight	354.188
Molweight	354.188
MonoisotopicMass	353.022163
CLogP	2.8043
CLogS	-4.371
H Acceptors	5
H Donors	1
TotalSurfaceArea	264.53
Relative PSA	0.23305
PolarSurfaceArea	68.54
Druglikeness	0.72199
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.69565
Fragments	1
Non HAtoms	23
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
Amides	1
StereoCon

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