(E)-2-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-thiophen-2-ylprop-2-enoic acid

Formula:C15H9N2O3FS2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-2-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-thiophen-2-ylprop-2-enoic acid is a drug-like molecule.

MolName	(E)-2-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-thiophen-2-ylprop-2-enoic acid
MolecularFormula	C15H9N2O3FS2
Smiles	OC(/C(/Sc1nnc(-c(cc2)ccc2F)o1)=C\c1cccs1)=O
InChI	InChI=1S/C15H9FN2O3S2/c16-10-5-3-9(4-6-10)13-17-18-15(21-13)23-12(14(19)20)8-11-2-1-7-22-11/h1-8H,(H,19,20)
InChIK	LWJYWEHKTWJUPP-UHFFFAOYSA-N
TotalMolweight	348.377
Molweight	348.377
MonoisotopicMass	348.003861
CLogP	3.3974
CLogS	-5.823
H Acceptors	5
H Donors	1
TotalSurfaceArea	248.58
Relative PSA	0.40245
PolarSurfaceArea	129.76
Druglikeness	1.8851
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6087
Fragments	1
Non HAtoms	23
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	2
Symmetricatoms	2
Aromatic Nitrogens	2
AcidicOxygens	1
StereoCon

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1 - (E)-2-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-thiophen-2-ylprop-2-enoic acid | 2 - (E)-2-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-thiophen-2-ylprop-2-enoic acid

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