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P-282763

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Name File
SDF P-282763.sdf
SMILES P-282763.smiles
Standard InChI P-282763.inchi
InChIKey P-282763.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-282763 Chemical Block Screening Library 90 452 mg
Property Value
Components 1
Mass 474.552
logP 5.38808
H-bond acceptors 6
H-bond donors 0
Rotatable bonds 2
PSA 69.34
RO5 violations 1
RO3 violations 4
Refractivity 145.33
Atoms 62
Rings 6
Heavy atoms 36
Hydrogen atoms 26
Heteroatoms 6
N/O atoms 6
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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