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P-107800

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Name File
SDF P-107800.sdf
SMILES P-107800.smiles
Standard InChI P-107800.inchi
InChIKey P-107800.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-107800 Chemical Block Screening Library 90 188 mg
Property Value
Components 1
Mass 479.396
logP 3.6043
H-bond acceptors 7
H-bond donors 2
Rotatable bonds 11
PSA 73.91
RO5 violations 0
RO3 violations 5
Refractivity 134.7194
Atoms 60
Rings 3
Heavy atoms 32
Hydrogen atoms 28
Heteroatoms 9
N/O atoms 7
Inorganic atoms 0
Halogen atoms 2
Chiral centers 0
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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