N-[(E)-[1-amino-2-(1,2,4-triazol-1-yl)ethylidene]amino]benzamide

Formula:C11H12N6O Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(E)-[1-amino-2-(1,2,4-triazol-1-yl)ethylidene]amino]benzamide is a drug-like molecule.

MolName	N-[(E)-[1-amino-2-(1,2,4-triazol-1-yl)ethylidene]amino]benzamide
MolecularFormula	C11H12N6O
Smiles	N/C(/Cn1ncnc1)=N/NC(c1ccccc1)=O
InChI	InChI=1S/C11H12N6O/c12-10(6-17-8-13-7-14-17)15-16-11(18)9-4-2-1-3-5-9/h1-5,7-8H,6H2,(H2,12,15)(H,16,18)
InChIK	LFOSQNMLHWWKQO-UHFFFAOYSA-N
TotalMolweight	244.257
Molweight	244.257
MonoisotopicMass	244.107259
CLogP	-0.2112
CLogS	-2.097
H Acceptors	7
H Donors	2
TotalSurfaceArea	194.2
Relative PSA	0.41241
PolarSurfaceArea	98.19
Druglikeness	5.5917
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone
Shape Index	0.66667
Fragments	1
Non HAtoms	18
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	1
Symmetricatoms	2
Aromatic Nitrogens	3
StereoCon

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