(Z)-N-(1,2,4-triazol-4-yl)-1-[4-[(Z)-1,2,4-triazol-4-yliminomethyl]phenyl]methanimine

Formula:C12H10N8 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-N-(1,2,4-triazol-4-yl)-1-[4-[(Z)-1,2,4-triazol-4-yliminomethyl]phenyl]methanimine is a drug-like molecule.

MolName(Z)-N-(1,2,4-triazol-4-yl)-1-[4-[(Z)-1,2,4-triazol-4-yliminomethyl]phenyl]methanimine
MolecularFormulaC12H10N8
SmilesC(c1ccc(/C=N\n2cnnc2)cc1)=N\n1cnnc1
InChIInChI=1S/C12H10N8/c1-2-12(6-18-20-9-15-16-10-20)4-3-11(1)5-17-19-7-13-14-8-19/h1-10H
InChIKVXYYGOUPBFKFRW-UHFFFAOYSA-N
TotalMolweight266.267
Molweight266.267
MonoisotopicMass266.102842
CLogP0.797
CLogS-7.004
H Acceptors8
TotalSurfaceArea215.74
Relative PSA0.37378
PolarSurfaceArea86.14
Druglikeness3.8706
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.7
Fragments1
Non HAtoms20
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond4
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms16
Symmetricatoms13
Aromatic Nitrogens6
StereoCon

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