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P-12803204

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Name File
SDF P-12803204.sdf
SMILES P-12803204.smiles
Standard InChI P-12803204.inchi
InChIKey P-12803204.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-12803204 InterBioScreen Screening Compounds 92 unavailable
Property Value
Components 1
Mass 510.577
logP 3.2843
H-bond acceptors 9
H-bond donors 2
Rotatable bonds 10
PSA 108.77
RO5 violations 1
RO3 violations 5
Refractivity 145.7503
Atoms 71
Rings 4
Heavy atoms 37
Hydrogen atoms 34
Heteroatoms 9
N/O atoms 9
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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