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P-491134159

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Name File
SDF P-491134159.sdf
SMILES P-491134159.smiles
Standard InChI P-491134159.inchi
InChIKey P-491134159.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-491134159 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 1
Mass 288.723
logP 4.0168
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 5
PSA 46.53
RO5 violations 0
RO3 violations 2
Refractivity 79.1008
Atoms 33
Rings 2
Heavy atoms 20
Hydrogen atoms 13
Heteroatoms 4
N/O atoms 3
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 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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