5-bromo-N-[(Z)-[5-bromo-2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-1-benzofuran-2-carboxamide

Formula:C27H18N2O3Br2 Mutagenic:high Tumorigenic:high Reproductive Effective:none 5-bromo-N-[(Z)-[5-bromo-2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-1-benzofuran-2-carboxamide is not a drug-like molecule.

MolName	5-bromo-N-[(Z)-[5-bromo-2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-1-benzofuran-2-carboxamide
MolecularFormula	C27H18N2O3Br2
Smiles	O=C(c1cc(cc(cc2)Br)c2o1)N/N=C\c(cc(cc1)Br)c1OCc1cccc2ccccc12
InChI	InChI=1S/C27H18Br2N2O3/c28-21-9-11-25-19(12-21)14-26(34-25)27(32)31-30-15-20-13-22(29)8-10-24(20)33-16-18-6-3-5-17-4-1-2-7-23(17)18/h1-15H,16H2,(H,31,32)
InChIK	DDNKNPSPVRGSMI-UHFFFAOYSA-N
TotalMolweight	578.259
Molweight	578.259
MonoisotopicMass	575.968415
CLogP	7.7001
CLogS	-9.519
H Acceptors	5
H Donors	1
TotalSurfaceArea	366.66
Relative PSA	0.16397
PolarSurfaceArea	63.83
Druglikeness	2.6867
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.55882
Fragments	1
Non HAtoms	34
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	25
Sp3Atoms	2
StereoCon

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