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P-889869170

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Name File
SDF P-889869170.sdf
SMILES P-889869170.smiles
Standard InChI P-889869170.inchi
InChIKey P-889869170.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-889869170 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 1
Mass 349.310
logP 2.1769
H-bond acceptors 6
H-bond donors 1
Rotatable bonds 5
PSA 76.72
RO5 violations 0
RO3 violations 4
Refractivity 81.1878
Atoms 39
Rings 3
Heavy atoms 25
Hydrogen atoms 14
Heteroatoms 9
N/O atoms 6
Inorganic atoms 0
Halogen atoms 3
Chiral centers 2
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 2
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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