2-(4-methylphenyl)-5-(2-methylsulfanylphenyl)-1,3,4-oxadiazole

Formula:C16H14N2OS Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(4-methylphenyl)-5-(2-methylsulfanylphenyl)-1,3,4-oxadiazole is a drug-like molecule.

MolName	2-(4-methylphenyl)-5-(2-methylsulfanylphenyl)-1,3,4-oxadiazole
MolecularFormula	C16H14N2OS
Smiles	Cc(cc1)ccc1-c1nnc(-c(cccc2)c2SC)o1
InChI	InChI=1S/C16H14N2OS/c1-11-7-9-12(10-8-11)15-17-18-16(19-15)13-5-3-4-6-14(13)20-2/h3-10H,1-2H3
InChIK	UMJFMSBVPGSJBQ-UHFFFAOYSA-N
TotalMolweight	282.366
Molweight	282.366
MonoisotopicMass	282.082683
CLogP	3.9488
CLogS	-6.682
H Acceptors	3
TotalSurfaceArea	222
Relative PSA	0.24117
PolarSurfaceArea	64.22
Druglikeness	0.3025
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6
Fragments	1
Non HAtoms	20
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	2
Aromatic Nitrogens	2
StereoCon

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