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P-502685067

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Name File
SDF P-502685067.sdf
SMILES P-502685067.smiles
Standard InChI P-502685067.inchi
InChIKey P-502685067.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502685067 Innovapharm Screening Compounds 90 in stock
Property Value
Components 1
Mass 368.451
logP 3.9116
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 5
PSA 85.22
RO5 violations 0
RO3 violations 5
Refractivity 110.5777
Atoms 46
Rings 3
Heavy atoms 26
Hydrogen atoms 20
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 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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