(E)-3-phenyl-N-[[4-(1,3-thiazol-4-ylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide

Formula:C19H16N4O3S3 Mutagenic:none Tumorigenic:none Reproductive Effective:high (E)-3-phenyl-N-[[4-(1,3-thiazol-4-ylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide is a drug-like molecule.

MolName	(E)-3-phenyl-N-[[4-(1,3-thiazol-4-ylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide
MolecularFormula	C19H16N4O3S3
Smiles	O=C(/C=C/c1ccccc1)NC(Nc(cc1)ccc1S(Nc1cscn1)(=O)=O)=S
InChI	InChI=1S/C19H16N4O3S3/c24-18(11-6-14-4-2-1-3-5-14)22-19(27)21-15-7-9-16(10-8-15)29(25,26)23-17-12-28-13-20-17/h1-13,23H,(H2,21,22,24,27)
InChIK	IOXLSAKUQCPKKY-UHFFFAOYSA-N
TotalMolweight	444.559
Molweight	444.559
MonoisotopicMass	444.038451
CLogP	2.7465
CLogS	-4.894
H Acceptors	7
H Donors	3
TotalSurfaceArea	327.4
Relative PSA	0.41335
PolarSurfaceArea	168.9
Druglikeness	1.4514
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.65517
Fragments	1
Non HAtoms	29
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Symmetricatoms	5
Amides	2
Aromatic Nitrogens	1
StereoCon

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