3-[[4-chloro-5-[(Z)-[(4-hydroxybenzoyl)hydrazinylidene]methyl]-2-oxo-1,3-thiazol-3-yl]methyl]benzoate

Formula:C19H13N3O5ClS Mutagenic:none Tumorigenic:none Reproductive Effective:none 3-[[4-chloro-5-[(Z)-[(4-hydroxybenzoyl)hydrazinylidene]methyl]-2-oxo-1,3-thiazol-3-yl]methyl]benzoate is a drug-like molecule.

MolName	3-[[4-chloro-5-[(Z)-[(4-hydroxybenzoyl)hydrazinylidene]methyl]-2-oxo-1,3-thiazol-3-yl]methyl]benzoate
MolecularFormula	C19H13N3O5ClS
Smiles	[O-]C(c1cccc(CN(C(Cl)=C(/C=N\NC(c(cc2)ccc2O)=O)S2)C2=O)c1)=O
InChI	InChI=1S/C19H14ClN3O5S/c20-16-15(9-21-22-17(25)12-4-6-14(24)7-5-12)29-19(28)23(16)10-11-2-1-3-13(8-11)18(26)27/h1-9,24H,10H2,(H,22,25)(H,26,27)/p-1
InChIK	VCSDQLHEHATUIH-UHFFFAOYSA-M
TotalMolweight	430.847
Molweight	430.847
MonoisotopicMass	430.026444
CLogP	0.6353
CLogS	-5.045
H Acceptors	8
H Donors	2
TotalSurfaceArea	302.76
Relative PSA	0.36501
PolarSurfaceArea	147.43
Druglikeness	7.4464
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	polar activated DB; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.62069
Fragments	1
Non HAtoms	29
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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