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MCULE-4021651893-3

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mcule product ID	Supplier	Catalog	Guaranteed purity (%)	Product matching	Availability
P-675272550	Innovapharm	Virtual Building Blocks	95	As a main component	by synthesis
P-502584212	Innovapharm	Virtual Building Blocks	95	As a main component	by synthesis
P-502584312	Innovapharm	Virtual Building Blocks	95	As a main component	by synthesis
P-675527820	Innovapharm	Virtual Screening Compounds	90	As a main component	by synthesis
P-675390725	Innovapharm	Screening Compounds	90	As a main component	in stock

Property	Value
Components	1
Mass	193.272
logP	0.9325
H-bond acceptors	4
H-bond donors	2
Rotatable bonds	0
PSA	96.11
RO5 violations	0
RO3 violations	2
Refractivity	48.7834
Atoms	20
Rings	2
Heavy atoms	11
Hydrogen atoms	9
Heteroatoms	6
N/O atoms	4
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	1
Cis/trans stereo double bonds	0
Unknown stereo double bonds	1
Undefined stereo double bonds	0