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P-503035365

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Name File
SDF P-503035365.sdf
SMILES P-503035365.smiles
Standard InChI P-503035365.inchi
InChIKey P-503035365.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-503035365 Innovapharm Virtual Screening Compounds 90 by synthesis
Property Value
Components 1
Mass 500.584
logP 5.5399
H-bond acceptors 7
H-bond donors 1
Rotatable bonds 10
PSA 88.96
RO5 violations 2
RO3 violations 5
Refractivity 145.8063
Atoms 69
Rings 4
Heavy atoms 37
Hydrogen atoms 32
Heteroatoms 7
N/O atoms 7
Inorganic atoms 0
Halogen atoms 0
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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