(3Z)-N-(2,3-dimethylphenyl)-3-[[2-(4-methylphenoxy)acetyl]hydrazinylidene]butanamide

Formula:C21H25N3O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (3Z)-N-(2,3-dimethylphenyl)-3-[[2-(4-methylphenoxy)acetyl]hydrazinylidene]butanamide is a drug-like molecule.

MolName	(3Z)-N-(2,3-dimethylphenyl)-3-[[2-(4-methylphenoxy)acetyl]hydrazinylidene]butanamide
MolecularFormula	C21H25N3O3
Smiles	C/C(/CC(Nc1c(C)c(C)ccc1)=O)=N/NC(COc1ccc(C)cc1)=O
InChI	InChI=1S/C21H25N3O3/c1-14-8-10-18(11-9-14)27-13-21(26)24-23-16(3)12-20(25)22-19-7-5-6-15(2)17(19)4/h5-11H,12-13H2,1-4H3,(H,22,25)(H,24,26)
InChIK	KQCHATPTFYDBTA-UHFFFAOYSA-N
TotalMolweight	367.448
Molweight	367.448
MonoisotopicMass	367.189592
CLogP	3.4344
CLogS	-4.743
H Acceptors	6
H Donors	2
TotalSurfaceArea	300.97
Relative PSA	0.23428
PolarSurfaceArea	79.79
Druglikeness	3.7967
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Nasty Functions	acyl-hydrazone
Shape Index	0.66667
Fragments	1
Non HAtoms	27
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	7
Symmetricatoms	2
Amides	1
StereoCon

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