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MCULE-4554010079

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mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-15951 Chemical Block Screening Library 90 As is unavailable
Property Value
Components 1
Mass 416.268
logP 3.3975
H-bond acceptors 6
H-bond donors 1
Rotatable bonds 5
PSA 71.0
RO5 violations 0
RO3 violations 5
Refractivity 106.5817
Atoms 44
Rings 3
Heavy atoms 26
Hydrogen atoms 18
Heteroatoms 7
N/O atoms 6
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 1
Cis/trans stereo double bonds 1
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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