N-[(Z)-[(Z)-2-bromo-3-phenylprop-2-enylidene]amino]-2-(1,3-dioxoisoindol-2-yl)acetamide

Formula:C19H14N3O3Br Mutagenic:high Tumorigenic:low Reproductive Effective:none N-[(Z)-[(Z)-2-bromo-3-phenylprop-2-enylidene]amino]-2-(1,3-dioxoisoindol-2-yl)acetamide is a drug-like molecule.

MolName	N-[(Z)-[(Z)-2-bromo-3-phenylprop-2-enylidene]amino]-2-(1,3-dioxoisoindol-2-yl)acetamide
MolecularFormula	C19H14N3O3Br
Smiles	O=C(CN(C(c1c2cccc1)=O)C2=O)N/N=C\C(\Br)=C\c1ccccc1
InChI	InChI=1S/C19H14BrN3O3/c20-14(10-13-6-2-1-3-7-13)11-21-22-17(24)12-23-18(25)15-8-4-5-9-16(15)19(23)26/h1-11H,12H2,(H,22,24)
InChIK	APOGWJOJFVCYBW-UHFFFAOYSA-N
TotalMolweight	412.242
Molweight	412.242
MonoisotopicMass	411.021853
CLogP	2.7914
CLogS	-4.617
H Acceptors	6
H Donors	1
TotalSurfaceArea	276.39
Relative PSA	0.23749
PolarSurfaceArea	78.84
Druglikeness	1.3204
Mutagenic	high
Tumorigenic	low
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.61538
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	7
Amides	1
StereoCon

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