(2Z)-2-[[2-(2-chlorophenyl)acetyl]hydrazinylidene]-2-phenylacetic acid

Formula:C16H13N2O3Cl Mutagenic:none Tumorigenic:none Reproductive Effective:low (2Z)-2-[[2-(2-chlorophenyl)acetyl]hydrazinylidene]-2-phenylacetic acid is a drug-like molecule.

MolName(2Z)-2-[[2-(2-chlorophenyl)acetyl]hydrazinylidene]-2-phenylacetic acid
MolecularFormulaC16H13N2O3Cl
SmilesOC(/C(/c1ccccc1)=N\NC(Cc(cccc1)c1Cl)=O)=O
InChIInChI=1S/C16H13ClN2O3/c17-13-9-5-4-8-12(13)10-14(20)18-19-15(16(21)22)11-6-2-1-3-7-11/h1-9H,10H2,(H,18,20)(H,21,22)
InChIKCGWVAUXUTDXZAA-UHFFFAOYSA-N
TotalMolweight316.743
Molweight316.743
MonoisotopicMass316.06147
CLogP2.4673
CLogS-4.257
H Acceptors5
H Donors2
TotalSurfaceArea238.48
Relative PSA0.26061
PolarSurfaceArea78.76
Druglikeness3.6401
Mutagenicnone
Tumorigenicnone
Reproductive Effectivelow
Irritantnone
Nasty Functionsacyl-hydrazone
Shape Index0.59091
Fragments1
Non HAtoms22
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond5
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms2
AcidicOxygens1
StereoCon

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