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

Formula:C16H12N2OBrF Mutagenic:high Tumorigenic:low Reproductive Effective:none N-[(Z)-[(Z)-2-bromo-3-phenylprop-2-enylidene]amino]-2-fluorobenzamide is a drug-like molecule.

MolName	N-[(Z)-[(Z)-2-bromo-3-phenylprop-2-enylidene]amino]-2-fluorobenzamide
MolecularFormula	C16H12N2OBrF
Smiles	O=C(c(cccc1)c1F)N/N=C\C(\Br)=C\c1ccccc1
InChI	InChI=1S/C16H12BrFN2O/c17-13(10-12-6-2-1-3-7-12)11-19-20-16(21)14-8-4-5-9-15(14)18/h1-11H,(H,20,21)
InChIK	VSIQBMYZUHVTDC-UHFFFAOYSA-N
TotalMolweight	347.186
Molweight	347.186
MonoisotopicMass	346.011702
CLogP	3.9133
CLogS	-5.16
H Acceptors	3
H Donors	1
TotalSurfaceArea	236.68
Relative PSA	0.15215
PolarSurfaceArea	41.46
Druglikeness	-2.0395
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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