(E)-N-[5-[(2-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide

Formula:C19H14N4OS2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-[5-[(2-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide is a drug-like molecule.

MolName	(E)-N-[5-[(2-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide
MolecularFormula	C19H14N4OS2
Smiles	N#Cc1c(CSc2nnc(NC(/C=C/c3ccccc3)=O)s2)cccc1
InChI	InChI=1S/C19H14N4OS2/c20-12-15-8-4-5-9-16(15)13-25-19-23-22-18(26-19)21-17(24)11-10-14-6-2-1-3-7-14/h1-11H,13H2,(H,21,22,24)
InChIK	DIKNWXWXZZUNOE-UHFFFAOYSA-N
TotalMolweight	378.479
Molweight	378.479
MonoisotopicMass	378.060901
CLogP	4.271
CLogS	-6.479
H Acceptors	5
H Donors	1
TotalSurfaceArea	294.91
Relative PSA	0.3318
PolarSurfaceArea	132.21
Druglikeness	-2.4628
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.65385
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	2
StereoCon

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