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P-504609445

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Name File
SDF P-504609445.sdf
SMILES P-504609445.smiles
Standard InChI P-504609445.inchi
InChIKey P-504609445.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-504609445 Innovapharm Virtual Screening Compounds 90 by synthesis
Property Value
Components 1
Mass 170.206
logP 3.4789
H-bond acceptors 1
H-bond donors 0
Rotatable bonds 2
PSA 9.23
RO5 violations 0
RO3 violations 1
Refractivity 52.958
Atoms 23
Rings 2
Heavy atoms 13
Hydrogen atoms 10
Heteroatoms 1
N/O atoms 1
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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