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P-502485497

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Name File
SDF P-502485497.sdf
SMILES P-502485497.smiles
Standard InChI P-502485497.inchi
InChIKey P-502485497.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502485497 Innovapharm Virtual Building Blocks 95 by synthesis
Property Value
Components 2
Mass 225.222
logP -2.8971
H-bond acceptors 7
H-bond donors 2
Rotatable bonds 1
PSA 136.56
RO5 violations 0
RO3 violations 2
Refractivity 44.5237
Atoms 25
Rings 1
Heavy atoms 14
Hydrogen atoms 11
Heteroatoms 8
N/O atoms 7
Inorganic atoms 0
Halogen atoms 0
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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