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P-885533789

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Name File
SDF P-885533789.sdf
SMILES P-885533789.smiles
Standard InChI P-885533789.inchi
InChIKey P-885533789.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-885533789 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 3
Mass 339.255
logP 2.9883
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 5
PSA 42.96
RO5 violations 0
RO3 violations 3
Refractivity 95.4557
Atoms 45
Rings 2
Heavy atoms 21
Hydrogen atoms 24
Heteroatoms 7
N/O atoms 5
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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