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P-502586968

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Name File
SDF P-502586968.sdf
SMILES P-502586968.smiles
Standard InChI P-502586968.inchi
InChIKey P-502586968.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502586968 Innovapharm Virtual Building Blocks 95 by synthesis
Property Value
Components 1
Mass 236.264
logP 3.7796
H-bond acceptors 2
H-bond donors 0
Rotatable bonds 2
PSA 26.3
RO5 violations 0
RO3 violations 1
Refractivity 72.7335
Atoms 30
Rings 3
Heavy atoms 18
Hydrogen atoms 12
Heteroatoms 2
N/O atoms 2
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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