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MCULE-5924521570

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mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-593954560 Otava Virtual BB 90 As is by synthesis October 24, 2019
Property Value
Components 1
Mass 175.213
logP 2.00988
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 1
PSA 80.71
RO5 violations 0
RO3 violations 1
Refractivity 46.6157
Atoms 17
Rings 2
Heavy atoms 12
Hydrogen atoms 5
Heteroatoms 4
N/O atoms 3
Inorganic atoms 0
Halogen atoms 0
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
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