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P-502591385

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Name File
SDF P-502591385.sdf
SMILES P-502591385.smiles
Standard InChI P-502591385.inchi
InChIKey P-502591385.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502591385 Innovapharm Screening Compounds 90 in stock
Property Value
Components 1
Mass 283.278
logP 1.7613
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 2
PSA 74.68
RO5 violations 0
RO3 violations 2
Refractivity 77.7763
Atoms 34
Rings 4
Heavy atoms 21
Hydrogen atoms 13
Heteroatoms 5
N/O atoms 5
Inorganic atoms 0
Halogen atoms 0
Chiral centers 4
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 4
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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