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P-885533516

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Name File
SDF P-885533516.sdf
SMILES P-885533516.smiles
Standard InChI P-885533516.inchi
InChIKey P-885533516.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-885533516 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 2
Mass 433.433
logP 3.1817
H-bond acceptors 9
H-bond donors 1
Rotatable bonds 2
PSA 126.61
RO5 violations 0
RO3 violations 4
Refractivity 107.2442
Atoms 49
Rings 5
Heavy atoms 30
Hydrogen atoms 19
Heteroatoms 10
N/O atoms 9
Inorganic atoms 0
Halogen atoms 0
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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