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P-889882058

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Name File
SDF P-889882058.sdf
SMILES P-889882058.smiles
Standard InChI P-889882058.inchi
InChIKey P-889882058.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-889882058 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 1
Mass 669.791
logP 6.4678
H-bond acceptors 9
H-bond donors 2
Rotatable bonds 11
PSA 164.37
RO5 violations 2
RO3 violations 5
Refractivity 186.7495
Atoms 79
Rings 6
Heavy atoms 47
Hydrogen atoms 32
Heteroatoms 12
N/O atoms 9
Inorganic atoms 0
Halogen atoms 1
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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