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UNKNOWN STEREO

P-502956320

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  1. InChIKey:
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Name File
SDF P-502956320.sdf
SMILES P-502956320.smiles
Standard InChI P-502956320.inchi
InChIKey P-502956320.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502956320 Innovapharm Screening Compounds 90 in stock
Property Value
Components 1
Mass 483.986
logP 5.1667
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 5
PSA 56.41
RO5 violations 1
RO3 violations 4
Refractivity 145.6577
Atoms 61
Rings 6
Heavy atoms 35
Hydrogen atoms 26
Heteroatoms 6
N/O atoms 5
Inorganic atoms 0
Halogen atoms 1
Chiral centers 2
R/S chiral centers 1
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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