(E)-3-anilino-2-(2H-tetrazol-5-yl)prop-2-enenitrile

Formula:C10H8N6 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-anilino-2-(2H-tetrazol-5-yl)prop-2-enenitrile is a drug-like molecule.

MolName	(E)-3-anilino-2-(2H-tetrazol-5-yl)prop-2-enenitrile
MolecularFormula	C10H8N6
Smiles	N#C/C(/c1n[nH]nn1)=C\Nc1ccccc1
InChI	InChI=1S/C10H8N6/c11-6-8(10-13-15-16-14-10)7-12-9-4-2-1-3-5-9/h1-5,7,12H,(H,13,14,15,16)
InChIK	SOXCTISAYHQOEE-UHFFFAOYSA-N
TotalMolweight	212.216
Molweight	212.216
MonoisotopicMass	212.081044
CLogP	0.0162
CLogS	-1.996
H Acceptors	6
H Donors	2
TotalSurfaceArea	176.75
Relative PSA	0.4069
PolarSurfaceArea	90.28
Druglikeness	-7.535
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.625
Fragments	1
Non HAtoms	16
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Symmetricatoms	2
Aromatic Nitrogens	4
StereoCon

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