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P-896628663

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Name File
SDF P-896628663.sdf
SMILES P-896628663.smiles
Standard InChI P-896628663.inchi
InChIKey P-896628663.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-896628663 MedChemExpress Screening compounds on demand 95 by synthesis
Property Value
Components 1
Mass 450.608
logP 6.6977
H-bond acceptors 4
H-bond donors 2
Rotatable bonds 1
PSA 74.6
RO5 violations 1
RO3 violations 4
Refractivity 131.2946
Atoms 71
Rings 5
Heavy atoms 33
Hydrogen atoms 38
Heteroatoms 4
N/O atoms 4
Inorganic atoms 0
Halogen atoms 0
Chiral centers 6
R/S chiral centers 6
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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