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MCULE-5371407715-1

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mcule product ID	Supplier	Catalog	Guaranteed purity (%)	Product matching	Availability
P-675522554	Innovapharm	Virtual Screening Compounds	90	As a main component	by synthesis
P-580010462	Innovapharm	Screening Compounds	90	As a main component	in stock
P-492240656	Innovapharm	Building Blocks	95	As a main component	in stock

Property	Value
Components	1
Mass	179.235
logP	1.1188
H-bond acceptors	2
H-bond donors	0
Rotatable bonds	1
PSA	40.13
RO5 violations	0
RO3 violations	0
Refractivity	49.5985
Atoms	28
Rings	2
Heavy atoms	13
Hydrogen atoms	15
Heteroatoms	2
N/O atoms	2
Inorganic atoms	0
Halogen atoms	0
Chiral centers	2
R/S chiral centers	0
Unknown chiral centers	0
Undefined chiral centers	2
Stereo double bonds	0
Cis/trans stereo double bonds	0
Unknown stereo double bonds	0
Undefined stereo double bonds	0