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P-505500869

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Name File
SDF P-505500869.sdf
SMILES P-505500869.smiles
Standard InChI P-505500869.inchi
InChIKey P-505500869.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-505500869 Hangzhou Apichem Building Blocks in stock 95 in stock
Property Value
Components 2
Mass 417.951
logP 5.3116
H-bond acceptors 7
H-bond donors 3
Rotatable bonds 8
PSA 111.14
RO5 violations 1
RO3 violations 5
Refractivity 111.6323
Atoms 55
Rings 2
Heavy atoms 27
Hydrogen atoms 28
Heteroatoms 9
N/O atoms 7
Inorganic atoms 0
Halogen atoms 1
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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