(5Z)-5-[(4-morpholin-4-ylphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C20H18N2O2S2 Mutagenic:high Tumorigenic:low Reproductive Effective:none (5Z)-5-[(4-morpholin-4-ylphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName(5Z)-5-[(4-morpholin-4-ylphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormulaC20H18N2O2S2
SmilesO=C(/C(/SC1=S)=C/c(cc2)ccc2N2CCOCC2)N1c1ccccc1
InChIInChI=1S/C20H18N2O2S2/c23-19-18(26-20(25)22(19)17-4-2-1-3-5-17)14-15-6-8-16(9-7-15)21-10-12-24-13-11-21/h1-9,14H,10-13H2
InChIKNSXHZFZGHPTBKF-UHFFFAOYSA-N
TotalMolweight382.507
Molweight382.507
MonoisotopicMass382.080968
CLogP2.5613
CLogS-5.086
H Acceptors4
TotalSurfaceArea284.32
Relative PSA0.266
PolarSurfaceArea90.17
Druglikeness3.2647
Mutagenichigh
Tumorigeniclow
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.61538
Fragments1
Non HAtoms26
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond3
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms7
Symmetricatoms6
Amides1
Amines1
Aromatic Amines1
StereoCon

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