2-[(E)-3-phenylprop-2-enyl]sulfanyl-1H-imidazo[4,5-b]pyridine

Formula:C15H13N3S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(E)-3-phenylprop-2-enyl]sulfanyl-1H-imidazo[4,5-b]pyridine is a drug-like molecule.

MolName	2-[(E)-3-phenylprop-2-enyl]sulfanyl-1H-imidazo[4,5-b]pyridine
MolecularFormula	C15H13N3S
Smiles	C(/C=C/c1ccccc1)Sc1nc(nccc2)c2[nH]1
InChI	InChI=1S/C15H13N3S/c1-2-6-12(7-3-1)8-5-11-19-15-17-13-9-4-10-16-14(13)18-15/h1-10H,11H2,(H,16,17,18)
InChIK	LYRMHQDYSNEQJO-UHFFFAOYSA-N
TotalMolweight	267.355
Molweight	267.355
MonoisotopicMass	267.083017
CLogP	3.5305
CLogS	-4.266
H Acceptors	3
H Donors	1
TotalSurfaceArea	212.46
Relative PSA	0.25144
PolarSurfaceArea	66.87
Druglikeness	0.24048
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.68421
Fragments	1
Non HAtoms	19
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	2
Symmetricatoms	2
Aromatic Nitrogens	3
BasicNitrogens	1
StereoCon

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