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MCULE-5646804426

Compound Show structure
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Property Value
Components 1
Mass 444.899
logP 5.5716
H-bond acceptors 4
H-bond donors 0
Rotatable bonds 4
PSA 34.47
RO5 violations 1
RO3 violations 4
Refractivity 121.1085
Atoms 54
Rings 4
Heavy atoms 31
Hydrogen atoms 23
Heteroatoms 7
N/O atoms 4
Inorganic atoms 0
Halogen atoms 3
Chiral centers 2
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 2
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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