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MCULE-8694719693

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mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-48130 Chemical Block Screening Library 90 As is 5 mg
Property Value
Components 1
Mass 441.452
logP 5.1106
H-bond acceptors 6
H-bond donors 2
Rotatable bonds 9
PSA 79.79
RO5 violations 1
RO3 violations 5
Refractivity 125.1784
Atoms 53
Rings 4
Heavy atoms 33
Hydrogen atoms 20
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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