N'-[(Z)-[amino(benzotriazol-1-yl)methylidene]amino]benzotriazole-1-carboximidamide

Formula:C14H12N10 Mutagenic:high Tumorigenic:high Reproductive Effective:none N'-[(Z)-[amino(benzotriazol-1-yl)methylidene]amino]benzotriazole-1-carboximidamide is a drug-like molecule.

MolName	N'-[(Z)-[amino(benzotriazol-1-yl)methylidene]amino]benzotriazole-1-carboximidamide
MolecularFormula	C14H12N10
Smiles	N/C(/n1nnc2c1cccc2)=N/N=C(/N)\n1nnc2c1cccc2
InChI	InChI=1S/C14H12N10/c15-13(23-11-7-3-1-5-9(11)17-21-23)19-20-14(16)24-12-8-4-2-6-10(12)18-22-24/h1-8H,(H2,15,19)(H2,16,20)
InChIK	CZVNBIXEZIISSV-UHFFFAOYSA-N
TotalMolweight	320.319
Molweight	320.319
MonoisotopicMass	320.12464
CLogP	2.192
CLogS	-5.226
H Acceptors	10
H Donors	2
TotalSurfaceArea	238.64
Relative PSA	0.46589
PolarSurfaceArea	138.18
Druglikeness	-2.7868
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	dimethylene-hydrazine
Shape Index	0.58333
Fragments	1
Non HAtoms	24
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	18
Symmetricatoms	12
Aromatic Nitrogens	6
BasicNitrogens	2
StereoCon

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