(Z)-1-(3-phenyl-1-thiophen-2-ylpyrazol-4-yl)-N-(1,2,4-triazol-4-yl)methanimine

Formula:C16H12N6S Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-(3-phenyl-1-thiophen-2-ylpyrazol-4-yl)-N-(1,2,4-triazol-4-yl)methanimine is a drug-like molecule.

MolName	(Z)-1-(3-phenyl-1-thiophen-2-ylpyrazol-4-yl)-N-(1,2,4-triazol-4-yl)methanimine
MolecularFormula	C16H12N6S
Smiles	C(c1cn(-c2cccs2)nc1-c1ccccc1)=N\n1cnnc1
InChI	InChI=1S/C16H12N6S/c1-2-5-13(6-3-1)16-14(9-19-21-11-17-18-12-21)10-22(20-16)15-7-4-8-23-15/h1-12H
InChIK	SKOANANDXYLZNX-UHFFFAOYSA-N
TotalMolweight	320.379
Molweight	320.379
MonoisotopicMass	320.084414
CLogP	2.2828
CLogS	-6.425
H Acceptors	6
TotalSurfaceArea	247.92
Relative PSA	0.31672
PolarSurfaceArea	89.13
Druglikeness	4.7865
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.47826
Fragments	1
Non HAtoms	23
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Symmetricatoms	4
Aromatic Nitrogens	5
StereoCon

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