3-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-1,2,5-oxadiazole-3,4-diamine

Formula:C9H7N5OCl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 3-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-1,2,5-oxadiazole-3,4-diamine is a drug-like molecule.

MolName	3-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-1,2,5-oxadiazole-3,4-diamine
MolecularFormula	C9H7N5OCl2
Smiles	Nc1nonc1N/N=C\c(ccc(Cl)c1)c1Cl
InChI	InChI=1S/C9H7Cl2N5O/c10-6-2-1-5(7(11)3-6)4-13-14-9-8(12)15-17-16-9/h1-4H,(H2,12,15)(H,14,16)
InChIK	HEDZUFBPNWRAIE-UHFFFAOYSA-N
TotalMolweight	272.095
Molweight	272.095
MonoisotopicMass	271.002764
CLogP	4.5897
CLogS	-3.99
H Acceptors	6
H Donors	2
TotalSurfaceArea	195.81
Relative PSA	0.3794
PolarSurfaceArea	89.33
Druglikeness	3.2266
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.64706
Fragments	1
Non HAtoms	17
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Aromatic Nitrogens	2
StereoCon

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1 - 3-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-1,2,5-oxadiazole-3,4-diamine | 2 - 3-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-1,2,5-oxadiazole-3,4-diamine

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