(E)-3-naphthalen-1-yl-N-[[[2-(4-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide

Formula:C28H23N3O3S Mutagenic:high Tumorigenic:high Reproductive Effective:high (E)-3-naphthalen-1-yl-N-[[[2-(4-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide is a drug-like molecule.

MolName	(E)-3-naphthalen-1-yl-N-[[[2-(4-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide
MolecularFormula	C28H23N3O3S
Smiles	O=C(COc(cc1)ccc1-c1ccccc1)NNC(NC(/C=C/c1cccc2ccccc12)=O)=S
InChI	InChI=1S/C28H23N3O3S/c32-26(18-15-23-11-6-10-22-9-4-5-12-25(22)23)29-28(35)31-30-27(33)19-34-24-16-13-21(14-17-24)20-7-2-1-3-8-20/h1-18H,19H2,(H,30,33)(H2,29,31,32,35)
InChIK	YEIHPKRQLQMHCZ-UHFFFAOYSA-N
TotalMolweight	481.575
Molweight	481.575
MonoisotopicMass	481.146012
CLogP	4.5577
CLogS	-7.697
H Acceptors	6
H Donors	3
TotalSurfaceArea	380.23
Relative PSA	0.25895
PolarSurfaceArea	111.55
Druglikeness	1.1197
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.65714
Fragments	1
Non HAtoms	35
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	3
Symmetricatoms	4
Amides	1
StereoCon

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