(E)-2-cyano-N-(2,3-dichlorophenyl)-3-(furan-2-yl)prop-2-enamide

Formula:C14H8N2O2Cl2 Mutagenic:high Tumorigenic:none Reproductive Effective:none (E)-2-cyano-N-(2,3-dichlorophenyl)-3-(furan-2-yl)prop-2-enamide is a drug-like molecule.

MolName	(E)-2-cyano-N-(2,3-dichlorophenyl)-3-(furan-2-yl)prop-2-enamide
MolecularFormula	C14H8N2O2Cl2
Smiles	N#C/C(/C(Nc1cccc(Cl)c1Cl)=O)=C\c1ccco1
InChI	InChI=1S/C14H8Cl2N2O2/c15-11-4-1-5-12(13(11)16)18-14(19)9(8-17)7-10-3-2-6-20-10/h1-7H,(H,18,19)
InChIK	RVPDXEGIFHTRBW-UHFFFAOYSA-N
TotalMolweight	307.136
Molweight	307.136
MonoisotopicMass	305.996282
CLogP	3.389
CLogS	-4.924
H Acceptors	4
H Donors	1
TotalSurfaceArea	229.18
Relative PSA	0.22764
PolarSurfaceArea	66.03
Druglikeness	-1.9385
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions	twice activated DB
Shape Index	0.55
Fragments	1
Non HAtoms	20
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Amides	1
StereoCon

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