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P-505497292

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Name File
SDF P-505497292.sdf
SMILES P-505497292.smiles
Standard InChI P-505497292.inchi
InChIKey P-505497292.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-505497292 Hangzhou Apichem Building Blocks in stock 95 in stock
Property Value
Components 2
Mass 608.164
logP 7.6133
H-bond acceptors 4
H-bond donors 1
Rotatable bonds 12
PSA 98.55
RO5 violations 2
RO3 violations 5
Refractivity 170.7033
Atoms 77
Rings 5
Heavy atoms 42
Hydrogen atoms 35
Heteroatoms 7
N/O atoms 4
Inorganic atoms 1
Halogen atoms 1
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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