(E)-2-cyano-N-(4-fluorophenyl)-3-[5-(4-sulfamoylphenyl)furan-2-yl]prop-2-enamide

Formula:C20H14N3O4FS Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-2-cyano-N-(4-fluorophenyl)-3-[5-(4-sulfamoylphenyl)furan-2-yl]prop-2-enamide is a drug-like molecule.

MolName	(E)-2-cyano-N-(4-fluorophenyl)-3-[5-(4-sulfamoylphenyl)furan-2-yl]prop-2-enamide
MolecularFormula	C20H14N3O4FS
Smiles	NS(c(cc1)ccc1-c1ccc(/C=C(/C(Nc(cc2)ccc2F)=O)\C#N)o1)(=O)=O
InChI	InChI=1S/C20H14FN3O4S/c21-15-3-5-16(6-4-15)24-20(25)14(12-22)11-17-7-10-19(28-17)13-1-8-18(9-2-13)29(23,26)27/h1-11H,(H,24,25)(H2,23,26,27)
InChIK	OPFMGANWNHJGRP-UHFFFAOYSA-N
TotalMolweight	411.412
Molweight	411.412
MonoisotopicMass	411.068905
CLogP	2.792
CLogS	-5.443
H Acceptors	7
H Donors	2
TotalSurfaceArea	301.55
Relative PSA	0.31842
PolarSurfaceArea	134.57
Druglikeness	0.1015
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.62069
Fragments	1
Non HAtoms	29
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
Symmetricatoms	5
Amides	2
StereoCon

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