N-[(Z)-(4-chlorophenyl)methylideneamino]-1H-1,2,4-triazol-5-amine

Formula:C9H8N5Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(4-chlorophenyl)methylideneamino]-1H-1,2,4-triazol-5-amine is a drug-like molecule.

MolName	N-[(Z)-(4-chlorophenyl)methylideneamino]-1H-1,2,4-triazol-5-amine
MolecularFormula	C9H8N5Cl
Smiles	Clc1ccc(/C=N\Nc2ncn[nH]2)cc1
InChI	InChI=1S/C9H8ClN5/c10-8-3-1-7(2-4-8)5-12-14-9-11-6-13-15-9/h1-6H,(H2,11,13,14,15)
InChIK	MUKJLHPUVVBJNO-UHFFFAOYSA-N
TotalMolweight	221.651
Molweight	221.651
MonoisotopicMass	221.046822
CLogP	3.5863
CLogS	-3.106
H Acceptors	5
H Donors	2
TotalSurfaceArea	171.75
Relative PSA	0.34294
PolarSurfaceArea	65.96
Druglikeness	3.5782
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.73333
Fragments	1
Non HAtoms	15
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Symmetricatoms	2
Aromatic Nitrogens	3
BasicNitrogens	1
StereoCon

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