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P-526220417

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Name File
SDF P-526220417.sdf
SMILES P-526220417.smiles
Standard InChI P-526220417.inchi
InChIKey P-526220417.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-526220417 Innovapharm Screening Compounds 90 in stock
Property Value
Components 1
Mass 299.350
logP 2.76568
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 6
PSA 100.31
RO5 violations 0
RO3 violations 3
Refractivity 80.9987
Atoms 34
Rings 2
Heavy atoms 21
Hydrogen atoms 13
Heteroatoms 6
N/O atoms 5
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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