(NE)-N-[1-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-yl)ethylidene]hydroxylamine

Formula:C10H8N4OCl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (NE)-N-[1-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-yl)ethylidene]hydroxylamine is a drug-like molecule.

MolName	(NE)-N-[1-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-yl)ethylidene]hydroxylamine
MolecularFormula	C10H8N4OCl2
Smiles	O/N=C(/Cn1ncnc1)\c(ccc(Cl)c1)c1Cl
InChI	InChI=1S/C10H8Cl2N4O/c11-7-1-2-8(9(12)3-7)10(15-17)4-16-6-13-5-14-16/h1-3,5-6,17H,4H2
InChIK	CNCXXOKGVGYHLY-UHFFFAOYSA-N
TotalMolweight	271.107
Molweight	271.107
MonoisotopicMass	270.007515
CLogP	2.2412
CLogS	-3.928
H Acceptors	5
H Donors	1
TotalSurfaceArea	193.66
Relative PSA	0.27584
PolarSurfaceArea	63.3
Druglikeness	3.5307
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.58824
Fragments	1
Non HAtoms	17
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	2
Aromatic Nitrogens	3
StereoCon

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1 - (NE)-N-[1-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-yl)ethylidene]hydroxylamine | 2 - (NE)-N-[1-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-yl)ethylidene]hydroxylamine

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