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P-502660432

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Name File
SDF P-502660432.sdf
SMILES P-502660432.smiles
Standard InChI P-502660432.inchi
InChIKey P-502660432.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502660432 Innovapharm Screening Compounds 90 in stock
Property Value
Components 1
Mass 472.488
logP 4.077
H-bond acceptors 8
H-bond donors 2
Rotatable bonds 9
PSA 109.19
RO5 violations 0
RO3 violations 5
Refractivity 132.7753
Atoms 59
Rings 4
Heavy atoms 35
Hydrogen atoms 24
Heteroatoms 8
N/O atoms 8
Inorganic atoms 0
Halogen atoms 0
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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