(E)-N-[[4-(carbamoylsulfamoyl)phenyl]carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide

Formula:C17H15N4O4FS2 Mutagenic:none Tumorigenic:none Reproductive Effective:high (E)-N-[[4-(carbamoylsulfamoyl)phenyl]carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide is a drug-like molecule.

MolName	(E)-N-[[4-(carbamoylsulfamoyl)phenyl]carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide
MolecularFormula	C17H15N4O4FS2
Smiles	NC(NS(c(cc1)ccc1NC(NC(/C=C/c(cc1)ccc1F)=O)=S)(=O)=O)=O
InChI	InChI=1S/C17H15FN4O4S2/c18-12-4-1-11(2-5-12)3-10-15(23)21-17(27)20-13-6-8-14(9-7-13)28(25,26)22-16(19)24/h1-10H,(H3,19,22,24)(H2,20,21,23,27)
InChIK	CRDLCZREOSDZJO-UHFFFAOYSA-N
TotalMolweight	422.46
Molweight	422.46
MonoisotopicMass	422.051874
CLogP	1.9791
CLogS	-4.455
H Acceptors	8
H Donors	4
TotalSurfaceArea	305.56
Relative PSA	0.43301
PolarSurfaceArea	170.86
Druglikeness	2.9275
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.67857
Fragments	1
Non HAtoms	28
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	5
Amides	3
StereoCon

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