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P-34502582

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Name File
SDF P-34502582.sdf
SMILES P-34502582.smiles
Standard InChI P-34502582.inchi
InChIKey P-34502582.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-34502582 Crea-Chim HTS compounds 90 unavailable
Property Value
Components 1
Mass 382.380
logP 4.2269
H-bond acceptors 6
H-bond donors 1
Rotatable bonds 4
PSA 63.3
RO5 violations 0
RO3 violations 5
Refractivity 99.1002
Atoms 48
Rings 4
Heavy atoms 27
Hydrogen atoms 21
Heteroatoms 9
N/O atoms 6
Inorganic atoms 0
Halogen atoms 3
Chiral centers 3
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 3
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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