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P-502747028

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Name File
SDF P-502747028.sdf
SMILES P-502747028.smiles
Standard InChI P-502747028.inchi
InChIKey P-502747028.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502747028 Innovapharm Screening Compounds 90 in stock
Property Value
Components 1
Mass 115.130
logP 0.1518
H-bond acceptors 3
H-bond donors 2
Rotatable bonds 1
PSA 49.33
RO5 violations 0
RO3 violations 0
Refractivity 32.5235
Atoms 17
Rings 1
Heavy atoms 8
Hydrogen atoms 9
Heteroatoms 3
N/O atoms 3
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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