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P-34491601

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Name File
SDF P-34491601.sdf
SMILES P-34491601.smiles
Standard InChI P-34491601.inchi
InChIKey P-34491601.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-34491601 Crea-Chim HTS compounds 90 unavailable
Property Value
Components 1
Mass 398.201
logP 4.422
H-bond acceptors 5
H-bond donors 0
Rotatable bonds 4
PSA 48.65
RO5 violations 0
RO3 violations 4
Refractivity 89.141
Atoms 38
Rings 3
Heavy atoms 24
Hydrogen atoms 14
Heteroatoms 8
N/O atoms 5
Inorganic atoms 0
Halogen atoms 3
Chiral centers 0
R/S chiral centers 0
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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