N,4-bis[(Z)-[(E)-3-phenylprop-2-enylidene]amino]-1,2,4-triazol-3-amine

Formula:C20H18N6 Mutagenic:none Tumorigenic:none Reproductive Effective:low N,4-bis[(Z)-[(E)-3-phenylprop-2-enylidene]amino]-1,2,4-triazol-3-amine is a drug-like molecule.

MolName	N,4-bis[(Z)-[(E)-3-phenylprop-2-enylidene]amino]-1,2,4-triazol-3-amine
MolecularFormula	C20H18N6
Smiles	C(/C=N\Nc1nncn1/N=C\C=C\c1ccccc1)=C/c1ccccc1
InChI	InChI=1S/C20H18N6/c1-3-9-18(10-4-1)13-7-15-21-24-20-25-22-17-26(20)23-16-8-14-19-11-5-2-6-12-19/h1-17H,(H,24,25)
InChIK	MCOBYYTXIFWZMI-UHFFFAOYSA-N
TotalMolweight	342.405
Molweight	342.405
MonoisotopicMass	342.159294
CLogP	4.8157
CLogS	-6.698
H Acceptors	6
H Donors	1
TotalSurfaceArea	293.48
Relative PSA	0.21565
PolarSurfaceArea	67.46
Druglikeness	4.6242
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.73077
Fragments	1
Non HAtoms	26
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Symmetricatoms	4
Aromatic Nitrogens	3
BasicNitrogens	1
StereoCon

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