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P-885543490

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Name File
SDF P-885543490.sdf
SMILES P-885543490.smiles
Standard InChI P-885543490.inchi
InChIKey P-885543490.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-885543490 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 1
Mass 403.969
logP 3.8835
H-bond acceptors 4
H-bond donors 1
Rotatable bonds 6
PSA 55.25
RO5 violations 0
RO3 violations 4
Refractivity 124.0808
Atoms 53
Rings 4
Heavy atoms 27
Hydrogen atoms 26
Heteroatoms 6
N/O atoms 4
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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