4-[(Z)-[[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]hydrazinylidene]methyl]benzoic acid

Formula:C17H11N3O2Cl2S Mutagenic:none Tumorigenic:high Reproductive Effective:none 4-[(Z)-[[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]hydrazinylidene]methyl]benzoic acid is not a drug-like molecule.

MolName	4-[(Z)-[[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]hydrazinylidene]methyl]benzoic acid
MolecularFormula	C17H11N3O2Cl2S
Smiles	OC(c1ccc(/C=N\Nc2nc(-c(ccc(Cl)c3)c3Cl)cs2)cc1)=O
InChI	InChI=1S/C17H11Cl2N3O2S/c18-12-5-6-13(14(19)7-12)15-9-25-17(21-15)22-20-8-10-1-3-11(4-2-10)16(23)24/h1-9H,(H,21,22)(H,23,24)
InChIK	CEOBBJDZSJPYKL-UHFFFAOYSA-N
TotalMolweight	392.265
Molweight	392.265
MonoisotopicMass	390.994901
CLogP	6.7431
CLogS	-6.145
H Acceptors	5
H Donors	2
TotalSurfaceArea	278.64
Relative PSA	0.28869
PolarSurfaceArea	102.82
Druglikeness	3.7497
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.68
Fragments	1
Non HAtoms	25
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
Symmetricatoms	2
Aromatic Nitrogens	1
BasicNitrogens	1
AcidicOxygens	1
StereoCon

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