3-bromo-N-[(Z)-[(Z)-2-bromo-3-phenylprop-2-enylidene]amino]benzamide

Formula:C16H12N2OBr2 Mutagenic:high Tumorigenic:low Reproductive Effective:none 3-bromo-N-[(Z)-[(Z)-2-bromo-3-phenylprop-2-enylidene]amino]benzamide is a drug-like molecule.

MolName	3-bromo-N-[(Z)-[(Z)-2-bromo-3-phenylprop-2-enylidene]amino]benzamide
MolecularFormula	C16H12N2OBr2
Smiles	O=C(c1cccc(Br)c1)N/N=C\C(\Br)=C\c1ccccc1
InChI	InChI=1S/C16H12Br2N2O/c17-14-8-4-7-13(10-14)16(21)20-19-11-15(18)9-12-5-2-1-3-6-12/h1-11H,(H,20,21)
InChIK	VAIIHHSBGOLRPA-UHFFFAOYSA-N
TotalMolweight	408.092
Molweight	408.092
MonoisotopicMass	405.931635
CLogP	4.5377
CLogS	-5.68
H Acceptors	3
H Donors	1
TotalSurfaceArea	248.96
Relative PSA	0.14464
PolarSurfaceArea	41.46
Druglikeness	-0.6995
Mutagenic	high
Tumorigenic	low
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.66667
Fragments	1
Non HAtoms	21
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Symmetricatoms	2
StereoCon

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