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P-597037782

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Name File
SDF P-597037782.sdf
SMILES P-597037782.smiles
Standard InChI P-597037782.inchi
InChIKey P-597037782.txt
Property Value
Components 1
Mass 505.444
logP 6.2838
H-bond acceptors 10
H-bond donors 10
Rotatable bonds 17
PSA 167.58
RO5 violations 3
RO3 violations 6
Refractivity 143.427
Atoms 64
Rings 2
Heavy atoms 34
Hydrogen atoms 30
Heteroatoms 12
N/O atoms 10
Inorganic atoms 0
Halogen atoms 2
Chiral centers 0
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 4
Cis/trans stereo double bonds 0
Unknown stereo double bonds 4
Undefined stereo double bonds 0
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