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P-502563690

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Name File
SDF P-502563690.sdf
SMILES P-502563690.smiles
Standard InChI P-502563690.inchi
InChIKey P-502563690.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502563690 Innovapharm Virtual Building Blocks 95 by synthesis
Property Value
Components 1
Mass 358.816
logP 2.9938
H-bond acceptors 5
H-bond donors 0
Rotatable bonds 6
PSA 51.13
RO5 violations 0
RO3 violations 3
Refractivity 104.811
Atoms 44
Rings 3
Heavy atoms 25
Hydrogen atoms 19
Heteroatoms 6
N/O atoms 5
Inorganic atoms 0
Halogen atoms 1
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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