(E)-3-(2-chlorophenyl)-N-[[[2-(4-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide

Formula:C24H20N3O3ClS Mutagenic:high Tumorigenic:high Reproductive Effective:high (E)-3-(2-chlorophenyl)-N-[[[2-(4-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide is a drug-like molecule.

MolName	(E)-3-(2-chlorophenyl)-N-[[[2-(4-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide
MolecularFormula	C24H20N3O3ClS
Smiles	O=C(COc(cc1)ccc1-c1ccccc1)NNC(NC(/C=C/c(cccc1)c1Cl)=O)=S
InChI	InChI=1S/C24H20ClN3O3S/c25-21-9-5-4-8-19(21)12-15-22(29)26-24(32)28-27-23(30)16-31-20-13-10-18(11-14-20)17-6-2-1-3-7-17/h1-15H,16H2,(H,27,30)(H2,26,28,29,32)
InChIK	CEQXODVQSWKSMN-UHFFFAOYSA-N
TotalMolweight	465.96
Molweight	465.96
MonoisotopicMass	465.091389
CLogP	3.9693
CLogS	-6.827
H Acceptors	6
H Donors	3
TotalSurfaceArea	361.05
Relative PSA	0.2727
PolarSurfaceArea	111.55
Druglikeness	1.1934
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.6875
Fragments	1
Non HAtoms	32
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	4
Amides	1
StereoCon

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