N-(3,4-dichlorophenyl)-N'-[3-(2-phenylethyl)oxadiazol-3-ium-5-yl]carbamimidate

Formula:C17H14N4O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-(3,4-dichlorophenyl)-N'-[3-(2-phenylethyl)oxadiazol-3-ium-5-yl]carbamimidate is a drug-like molecule.

MolName	N-(3,4-dichlorophenyl)-N'-[3-(2-phenylethyl)oxadiazol-3-ium-5-yl]carbamimidate
MolecularFormula	C17H14N4O2Cl2
Smiles	[O-]/C(/Nc(cc1)cc(Cl)c1Cl)=N/c1c[n+](CCc2ccccc2)no1
InChI	InChI=1S/C17H14Cl2N4O2/c18-14-7-6-13(10-15(14)19)20-17(24)21-16-11-23(22-25-16)9-8-12-4-2-1-3-5-12/h1-7,10-11H,8-9H2,(H-,20,21,22,24)
InChIK	DEVIBLJUXPTNNN-UHFFFAOYSA-N
TotalMolweight	377.23
Molweight	377.23
MonoisotopicMass	376.04938
CLogP	-0.209
CLogS	-5.78
H Acceptors	6
H Donors	1
TotalSurfaceArea	278.85
Relative PSA	0.23342
PolarSurfaceArea	77.36
Druglikeness	-0.79282
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.68
Fragments	1
Non HAtoms	25
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	2
Aromatic Nitrogens	2
StereoCon

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