(E)-3-phenyl-N-[5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3,4-oxadiazol-2-yl]prop-2-enamide

Formula:C21H19N3O2 Mutagenic:none Tumorigenic:high Reproductive Effective:none (E)-3-phenyl-N-[5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3,4-oxadiazol-2-yl]prop-2-enamide is a drug-like molecule.

MolName	(E)-3-phenyl-N-[5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3,4-oxadiazol-2-yl]prop-2-enamide
MolecularFormula	C21H19N3O2
Smiles	O=C(/C=C/c1ccccc1)Nc1nnc(-c2cc(CCCC3)c3cc2)o1
InChI	InChI=1S/C21H19N3O2/c25-19(13-10-15-6-2-1-3-7-15)22-21-24-23-20(26-21)18-12-11-16-8-4-5-9-17(16)14-18/h1-3,6-7,10-14H,4-5,8-9H2,(H,22,24,25)
InChIK	YSHFPOCLENQUDE-UHFFFAOYSA-N
TotalMolweight	345.401
Molweight	345.401
MonoisotopicMass	345.147727
CLogP	4.4877
CLogS	-6.59
H Acceptors	5
H Donors	1
TotalSurfaceArea	277.24
Relative PSA	0.2184
PolarSurfaceArea	68.02
Druglikeness	-4.4734
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.65385
Fragments	1
Non HAtoms	26
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	4
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	2
StereoCon

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