(5Z)-2-[4-(2-hydroxyethyl)piperazin-1-yl]-5-[(2-hydroxyphenyl)methylidene]-1,3-thiazol-4-one

Formula:C16H19N3O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-2-[4-(2-hydroxyethyl)piperazin-1-yl]-5-[(2-hydroxyphenyl)methylidene]-1,3-thiazol-4-one is a drug-like molecule.

MolName	(5Z)-2-[4-(2-hydroxyethyl)piperazin-1-yl]-5-[(2-hydroxyphenyl)methylidene]-1,3-thiazol-4-one
MolecularFormula	C16H19N3O3S
Smiles	OCCN(CC1)CCN1C(S/C1=C\c(cccc2)c2O)=NC1=O
InChI	InChI=1S/C16H19N3O3S/c20-10-9-18-5-7-19(8-6-18)16-17-15(22)14(23-16)11-12-3-1-2-4-13(12)21/h1-4,11,20-21H,5-10H2
InChIK	IGFDLRQFNXTZKU-UHFFFAOYSA-N
TotalMolweight	333.411
Molweight	333.411
MonoisotopicMass	333.114712
CLogP	0.8283
CLogS	-1.909
H Acceptors	6
H Donors	2
TotalSurfaceArea	245.04
Relative PSA	0.30746
PolarSurfaceArea	101.67
Druglikeness	7.8124
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.65217
Fragments	1
Non HAtoms	23
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	10
Symmetricatoms	2
Amines	1
AlkylAmines	1
BasicNitrogens	2
StereoCon

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