(Z)-1-(5-bromofuran-2-yl)-N-(1,2,4-triazol-4-yl)methanimine

Formula:C7H5N4OBr Mutagenic:high Tumorigenic:high Reproductive Effective:high (Z)-1-(5-bromofuran-2-yl)-N-(1,2,4-triazol-4-yl)methanimine is a drug-like molecule.

MolName	(Z)-1-(5-bromofuran-2-yl)-N-(1,2,4-triazol-4-yl)methanimine
MolecularFormula	C7H5N4OBr
Smiles	Brc1ccc(/C=N\n2cnnc2)o1
InChI	InChI=1S/C7H5BrN4O/c8-7-2-1-6(13-7)3-11-12-4-9-10-5-12/h1-5H
InChIK	LSUOXYSGQRVHMY-UHFFFAOYSA-N
TotalMolweight	241.048
Molweight	241.048
MonoisotopicMass	239.964672
CLogP	1.2396
CLogS	-4.589
H Acceptors	5
TotalSurfaceArea	152.82
Relative PSA	0.35617
PolarSurfaceArea	56.21
Druglikeness	2.757
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.69231
Fragments	1
Non HAtoms	13
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	2
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	10
Symmetricatoms	2
Aromatic Nitrogens	3
StereoCon

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