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P-885534956

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Name File
SDF P-885534956.sdf
SMILES P-885534956.smiles
Standard InChI P-885534956.inchi
InChIKey P-885534956.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-885534956 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 1
Mass 314.850
logP 4.5934
H-bond acceptors 2
H-bond donors 0
Rotatable bonds 4
PSA 6.48
RO5 violations 0
RO3 violations 3
Refractivity 98.774
Atoms 45
Rings 3
Heavy atoms 22
Hydrogen atoms 23
Heteroatoms 3
N/O atoms 2
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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