N-(4-bromophenyl)-N'-[(Z)-furan-2-ylmethylideneamino]oxamide

Formula:C13H10N3O3Br Mutagenic:high Tumorigenic:high Reproductive Effective:none N-(4-bromophenyl)-N'-[(Z)-furan-2-ylmethylideneamino]oxamide is a drug-like molecule.

MolName	N-(4-bromophenyl)-N'-[(Z)-furan-2-ylmethylideneamino]oxamide
MolecularFormula	C13H10N3O3Br
Smiles	O=C(C(N/N=C\c1ccco1)=O)Nc(cc1)ccc1Br
InChI	InChI=1S/C13H10BrN3O3/c14-9-3-5-10(6-4-9)16-12(18)13(19)17-15-8-11-2-1-7-20-11/h1-8H,(H,16,18)(H,17,19)
InChIK	SOCCBOHWSLJARB-UHFFFAOYSA-N
TotalMolweight	336.144
Molweight	336.144
MonoisotopicMass	334.990553
CLogP	2.0578
CLogS	-4.041
H Acceptors	6
H Donors	2
TotalSurfaceArea	224.52
Relative PSA	0.33235
PolarSurfaceArea	83.7
Druglikeness	1.7155
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide
Shape Index	0.7
Fragments	1
Non HAtoms	20
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Symmetricatoms	2
Amides	1
StereoCon

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