2-[(2E)-2-(cyclooctylidenehydrazinylidene)-4-oxo-3-phenyl-1,3-thiazolidin-5-yl]acetic acid

Formula:C19H23N3O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(2E)-2-(cyclooctylidenehydrazinylidene)-4-oxo-3-phenyl-1,3-thiazolidin-5-yl]acetic acid is not a drug-like molecule.

MolName	2-[(2E)-2-(cyclooctylidenehydrazinylidene)-4-oxo-3-phenyl-1,3-thiazolidin-5-yl]acetic acid
MolecularFormula	C19H23N3O3S
Smiles	OC(CC(C(N1c2ccccc2)=O)S/C1=N/N=C1CCCCCCC1)=O
InChI	InChI=1S/C19H23N3O3S/c23-17(24)13-16-18(25)22(15-11-7-4-8-12-15)19(26-16)21-20-14-9-5-2-1-3-6-10-14/h4,7-8,11-12,16H,1-3,5-6,9-10,13H2,(H,23,24)/t16-/m0/s1
InChIK	SUNHNCOUVBVRPZ-INIZCTEOSA-N
TotalMolweight	373.476
Molweight	373.476
MonoisotopicMass	373.146012
CLogP	5.1563
CLogS	-5.337
H Acceptors	6
H Donors	1
TotalSurfaceArea	284.42
Relative PSA	0.29267
PolarSurfaceArea	107.63
Druglikeness	0.058851
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	dimethylene-hydrazine
Shape Index	0.5
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	1
Rotatable Bond	4
Rings Closures	3
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	11
Symmetricatoms	5
Amides	1
AcidicOxygens	1
StereoCon	racemate

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