N-[(Z)-(4-anilino-1-chloro-4-oxobutan-2-ylidene)amino]benzamide

Formula:C17H16N3O2Cl Mutagenic:low Tumorigenic:high Reproductive Effective:high N-[(Z)-(4-anilino-1-chloro-4-oxobutan-2-ylidene)amino]benzamide is a drug-like molecule.

MolName	N-[(Z)-(4-anilino-1-chloro-4-oxobutan-2-ylidene)amino]benzamide
MolecularFormula	C17H16N3O2Cl
Smiles	O=C(C/C(/CCl)=N/NC(c1ccccc1)=O)Nc1ccccc1
InChI	InChI=1S/C17H16ClN3O2/c18-12-15(11-16(22)19-14-9-5-2-6-10-14)20-21-17(23)13-7-3-1-4-8-13/h1-10H,11-12H2,(H,19,22)(H,21,23)
InChIK	HSBKPEXIXLOTND-UHFFFAOYSA-N
TotalMolweight	329.786
Molweight	329.786
MonoisotopicMass	329.093104
CLogP	3.0571
CLogS	-4.332
H Acceptors	5
H Donors	2
TotalSurfaceArea	257.35
Relative PSA	0.23513
PolarSurfaceArea	70.56
Druglikeness	3.9777
Mutagenic	low
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone
Shape Index	0.65217
Fragments	1
Non HAtoms	23
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	4
Amides	1
StereoCon

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