(E)-N-[[(2-phenoxyacetyl)amino]carbamothioyl]-3-thiophen-2-ylprop-2-enamide

Formula:C16H15N3O3S2 Mutagenic:high Tumorigenic:none Reproductive Effective:high (E)-N-[[(2-phenoxyacetyl)amino]carbamothioyl]-3-thiophen-2-ylprop-2-enamide is a drug-like molecule.

MolName	(E)-N-[[(2-phenoxyacetyl)amino]carbamothioyl]-3-thiophen-2-ylprop-2-enamide
MolecularFormula	C16H15N3O3S2
Smiles	O=C(COc1ccccc1)NNC(NC(/C=C/c1cccs1)=O)=S
InChI	InChI=1S/C16H15N3O3S2/c20-14(9-8-13-7-4-10-24-13)17-16(23)19-18-15(21)11-22-12-5-2-1-3-6-12/h1-10H,11H2,(H,18,21)(H2,17,19,20,23)
InChIK	QJTXMUQCOIQHPN-UHFFFAOYSA-N
TotalMolweight	361.445
Molweight	361.445
MonoisotopicMass	361.055482
CLogP	1.5707
CLogS	-4.015
H Acceptors	6
H Donors	3
TotalSurfaceArea	281.81
Relative PSA	0.42163
PolarSurfaceArea	139.79
Druglikeness	2.9231
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.70833
Fragments	1
Non HAtoms	24
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
Symmetricatoms	2
Amides	1
StereoCon

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