(E)-3-(furan-2-yl)-N-[[[2-(2-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide

Formula:C22H19N3O4S Mutagenic:high Tumorigenic:none Reproductive Effective:high (E)-3-(furan-2-yl)-N-[[[2-(2-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide is a drug-like molecule.

MolName	(E)-3-(furan-2-yl)-N-[[[2-(2-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide
MolecularFormula	C22H19N3O4S
Smiles	O=C(COc(cccc1)c1-c1ccccc1)NNC(NC(/C=C/c1ccco1)=O)=S
InChI	InChI=1S/C22H19N3O4S/c26-20(13-12-17-9-6-14-28-17)23-22(30)25-24-21(27)15-29-19-11-5-4-10-18(19)16-7-2-1-3-8-16/h1-14H,15H2,(H,24,27)(H2,23,25,26,30)
InChIK	IEEYHNSNBHZSSG-UHFFFAOYSA-N
TotalMolweight	421.476
Molweight	421.476
MonoisotopicMass	421.109627
CLogP	2.552
CLogS	-5.773
H Acceptors	7
H Donors	3
TotalSurfaceArea	335.32
Relative PSA	0.33571
PolarSurfaceArea	124.69
Druglikeness	1.3184
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.63333
Fragments	1
Non HAtoms	30
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	2
Amides	1
StereoCon

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