3-[(5Z)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(3-morpholin-4-ylpropyl)propanamide

Formula:C20H25N3O3S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 3-[(5Z)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(3-morpholin-4-ylpropyl)propanamide is a drug-like molecule.

MolName	3-[(5Z)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(3-morpholin-4-ylpropyl)propanamide
MolecularFormula	C20H25N3O3S2
Smiles	O=C(CCN(C(/C(/S1)=C/c2ccccc2)=O)C1=S)NCCCN1CCOCC1
InChI	InChI=1S/C20H25N3O3S2/c24-18(21-8-4-9-22-11-13-26-14-12-22)7-10-23-19(25)17(28-20(23)27)15-16-5-2-1-3-6-16/h1-3,5-6,15H,4,7-14H2,(H,21,24)
InChIK	VXMOKXBJRMKILQ-UHFFFAOYSA-N
TotalMolweight	419.569
Molweight	419.569
MonoisotopicMass	419.133732
CLogP	1.0584
CLogS	-2.935
H Acceptors	6
H Donors	1
TotalSurfaceArea	322.57
Relative PSA	0.31041
PolarSurfaceArea	119.27
Druglikeness	5.0461
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.67857
Fragments	1
Non HAtoms	28
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	13
Symmetricatoms	4
Amides	2
Amines	1
AlkylAmines	1
BasicNitrogens	1
StereoCon

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