(4E)-4-[(2,4-dichlorobenzoyl)hydrazinylidene]-4-phenylbutanoic acid

Formula:C17H14N2O3Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (4E)-4-[(2,4-dichlorobenzoyl)hydrazinylidene]-4-phenylbutanoic acid is a drug-like molecule.

MolName	(4E)-4-[(2,4-dichlorobenzoyl)hydrazinylidene]-4-phenylbutanoic acid
MolecularFormula	C17H14N2O3Cl2
Smiles	OC(CC/C(/c1ccccc1)=N\NC(c(ccc(Cl)c1)c1Cl)=O)=O
InChI	InChI=1S/C17H14Cl2N2O3/c18-12-6-7-13(14(19)10-12)17(24)21-20-15(8-9-16(22)23)11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H,21,24)(H,22,23)
InChIK	JSHDDXKWRGZBTJ-UHFFFAOYSA-N
TotalMolweight	365.215
Molweight	365.215
MonoisotopicMass	364.038147
CLogP	3.984
CLogS	-5.568
H Acceptors	5
H Donors	2
TotalSurfaceArea	267.66
Relative PSA	0.2322
PolarSurfaceArea	78.76
Druglikeness	2.0828
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone
Shape Index	0.54167
Fragments	1
Non HAtoms	24
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	2
AcidicOxygens	1
StereoCon

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