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P-503069534

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Name File
SDF P-503069534.sdf
SMILES P-503069534.smiles
Standard InChI P-503069534.inchi
InChIKey P-503069534.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-503069534 Innovapharm Virtual Screening Compounds 90 by synthesis
Property Value
Components 1
Mass 465.922
logP 5.8283
H-bond acceptors 6
H-bond donors 1
Rotatable bonds 9
PSA 79.98
RO5 violations 1
RO3 violations 5
Refractivity 129.0223
Atoms 57
Rings 4
Heavy atoms 33
Hydrogen atoms 24
Heteroatoms 7
N/O atoms 6
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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