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P-503464772

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Name File
SDF P-503464772.sdf
SMILES P-503464772.smiles
Standard InChI P-503464772.inchi
InChIKey P-503464772.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-503464772 Innovapharm Virtual Screening Compounds 90 by synthesis
Property Value
Components 1
Mass 476.495
logP 3.9821
H-bond acceptors 7
H-bond donors 0
Rotatable bonds 7
PSA 80.06
RO5 violations 0
RO3 violations 5
Refractivity 136.1575
Atoms 60
Rings 5
Heavy atoms 35
Hydrogen atoms 25
Heteroatoms 8
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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