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

Formula:C23H26N2O2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-(1-adamantyl)-3-[(5Z)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanamide is a drug-like molecule.

MolName	N-(1-adamantyl)-3-[(5Z)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanamide
MolecularFormula	C23H26N2O2S2
Smiles	O=C(CCN(C(/C(/S1)=C/c2ccccc2)=O)C1=S)NC1(CC(C2)C3)CC3CC2C1
InChI	InChI=1S/C23H26N2O2S2/c26-20(24-23-12-16-8-17(13-23)10-18(9-16)14-23)6-7-25-21(27)19(29-22(25)28)11-15-4-2-1-3-5-15/h1-5,11,16-18H,6-10,12-14H2,(H,24,26)
InChIK	VZLMNVJVQVEGJM-UHFFFAOYSA-N
TotalMolweight	426.603
Molweight	426.603
MonoisotopicMass	426.143568
CLogP	3.0104
CLogS	-5.51
H Acceptors	4
H Donors	1
TotalSurfaceArea	309.42
Relative PSA	0.27981
PolarSurfaceArea	106.8
Druglikeness	5.7419
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.55172
Fragments	1
Non HAtoms	29
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	5
Small Rings	6
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	14
Symmetricatoms	8
Amides	2
StereoCon

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