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

Formula:C7H5N4BrS Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-(4-bromothiophen-2-yl)-N-(1,2,4-triazol-4-yl)methanimine is a drug-like molecule.

MolName	(Z)-1-(4-bromothiophen-2-yl)-N-(1,2,4-triazol-4-yl)methanimine
MolecularFormula	C7H5N4BrS
Smiles	Brc1csc(/C=N\n2cnnc2)c1
InChI	InChI=1S/C7H5BrN4S/c8-6-1-7(13-3-6)2-11-12-4-9-10-5-12/h1-5H
InChIK	YMZMEBCCLBZLGL-UHFFFAOYSA-N
TotalMolweight	257.115
Molweight	257.115
MonoisotopicMass	255.941827
CLogP	1.8201
CLogS	-5.154
H Acceptors	4
TotalSurfaceArea	159.07
Relative PSA	0.38147
PolarSurfaceArea	71.31
Druglikeness	-0.55949
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
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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