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P-502612262

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Name File
SDF P-502612262.sdf
SMILES P-502612262.smiles
Standard InChI P-502612262.inchi
InChIKey P-502612262.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502612262 Innovapharm Screening Compounds 90 in stock
Property Value
Components 1
Mass 305.351
logP 3.4894
H-bond acceptors 5
H-bond donors 2
Rotatable bonds 4
PSA 107.78
RO5 violations 0
RO3 violations 5
Refractivity 79.9975
Atoms 36
Rings 3
Heavy atoms 21
Hydrogen atoms 15
Heteroatoms 6
N/O atoms 5
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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