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MCULE-9657014918-1

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mcule product ID	Supplier	Catalog	Guaranteed purity (%)	Product matching	Availability
P-504021590	Innovapharm	Virtual Screening Compounds	90	As a main component	by synthesis
P-504022009	Innovapharm	Virtual Screening Compounds	90	As a main component	by synthesis
P-504022411	Innovapharm	Virtual Screening Compounds	90	As a main component	by synthesis

Property	Value
Components	1
Mass	213.635
logP	1.2489
H-bond acceptors	3
H-bond donors	0
Rotatable bonds	5
PSA	49.36
RO5 violations	0
RO3 violations	1
Refractivity	52.1945
Atoms	24
Rings	1
Heavy atoms	14
Hydrogen atoms	10
Heteroatoms	4
N/O atoms	3
Inorganic atoms	0
Halogen atoms	1
Chiral centers	0
R/S chiral centers	0
Unknown chiral centers	0
Undefined chiral centers	0
Stereo double bonds	0
Cis/trans stereo double bonds	0
Unknown stereo double bonds	0
Undefined stereo double bonds	0