5-[(E)-2-(4-chlorophenyl)ethenyl]-1,3,4-oxadiazol-2-amine

Formula:C10H8N3OCl Mutagenic:high Tumorigenic:high Reproductive Effective:none 5-[(E)-2-(4-chlorophenyl)ethenyl]-1,3,4-oxadiazol-2-amine is a drug-like molecule.

MolName	5-[(E)-2-(4-chlorophenyl)ethenyl]-1,3,4-oxadiazol-2-amine
MolecularFormula	C10H8N3OCl
Smiles	Nc1nnc(/C=C/c(cc2)ccc2Cl)o1
InChI	InChI=1S/C10H8ClN3O/c11-8-4-1-7(2-5-8)3-6-9-13-14-10(12)15-9/h1-6H,(H2,12,14)
InChIK	XXROIJAASWJIDO-UHFFFAOYSA-N
TotalMolweight	221.647
Molweight	221.647
MonoisotopicMass	221.035589
CLogP	2.2364
CLogS	-3.703
H Acceptors	4
H Donors	1
TotalSurfaceArea	170.67
Relative PSA	0.3007
PolarSurfaceArea	64.94
Druglikeness	0.45876
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.73333
Fragments	1
Non HAtoms	15
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	2
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Symmetricatoms	2
Aromatic Nitrogens	2
StereoCon

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