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MCULE-5895117546

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mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-608233353 Enamine Building Blocks (On Demand) 90 As is by synthesis May 27, 2020
Property Value
Components 1
Mass 461.980
logP 6.3946
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 10
PSA 62.3
RO5 violations 1
RO3 violations 5
Refractivity 135.1917
Atoms 61
Rings 3
Heavy atoms 33
Hydrogen atoms 28
Heteroatoms 6
N/O atoms 5
Inorganic atoms 0
Halogen atoms 1
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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