(4Z)-4-[[2-[[2-(4-chlorophenyl)acetyl]amino]acetyl]hydrazinylidene]-4-phenylbutanoic acid

Formula:C20H20N3O4Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none (4Z)-4-[[2-[[2-(4-chlorophenyl)acetyl]amino]acetyl]hydrazinylidene]-4-phenylbutanoic acid is a drug-like molecule.

MolName(4Z)-4-[[2-[[2-(4-chlorophenyl)acetyl]amino]acetyl]hydrazinylidene]-4-phenylbutanoic acid
MolecularFormulaC20H20N3O4Cl
SmilesOC(CC/C(/c1ccccc1)=N/NC(CNC(Cc(cc1)ccc1Cl)=O)=O)=O
InChIInChI=1S/C20H20ClN3O4/c21-16-8-6-14(7-9-16)12-18(25)22-13-19(26)24-23-17(10-11-20(27)28)15-4-2-1-3-5-15/h1-9H,10-13H2,(H,22,25)(H,24,26)(H,27,28)
InChIKLBPJVHVHIPJHMG-UHFFFAOYSA-N
TotalMolweight401.849
Molweight401.849
MonoisotopicMass401.114234
CLogP2.4598
CLogS-4.564
H Acceptors7
H Donors3
TotalSurfaceArea308.97
Relative PSA0.28045
PolarSurfaceArea107.86
Druglikeness3.5538
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone
Shape Index0.60714
Fragments1
Non HAtoms28
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond9
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms5
Symmetricatoms4
Amides1
AcidicOxygens1
StereoCon

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