(4Z)-4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]hydrazinylidene]-4-phenylbutanoic acid

Formula:C16H13N3O2ClF3 Mutagenic:none Tumorigenic:high Reproductive Effective:low (4Z)-4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]hydrazinylidene]-4-phenylbutanoic acid is not a drug-like molecule.

MolName	(4Z)-4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]hydrazinylidene]-4-phenylbutanoic acid
MolecularFormula	C16H13N3O2ClF3
Smiles	OC(CC/C(/c1ccccc1)=N/Nc(ncc(C(F)(F)F)c1)c1Cl)=O
InChI	InChI=1S/C16H13ClF3N3O2/c17-12-8-11(16(18,19)20)9-21-15(12)23-22-13(6-7-14(24)25)10-4-2-1-3-5-10/h1-5,8-9H,6-7H2,(H,21,23)(H,24,25)
InChIK	RFFQJWDKJXBUPB-UHFFFAOYSA-N
TotalMolweight	371.745
Molweight	371.745
MonoisotopicMass	371.064838
CLogP	5.0457
CLogS	-4.768
H Acceptors	5
H Donors	2
TotalSurfaceArea	262.71
Relative PSA	0.22869
PolarSurfaceArea	74.58
Druglikeness	-7.0754
Mutagenic	none
Tumorigenic	high
Reproductive Effective	low
Irritant	high
Nasty Functions
Shape Index	0.52
Fragments	1
Non HAtoms	25
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	4
Aromatic Nitrogens	1
BasicNitrogens	1
AcidicOxygens	1
StereoCon

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