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P-502983363

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Name File
SDF P-502983363.sdf
SMILES P-502983363.smiles
Standard InChI P-502983363.inchi
InChIKey P-502983363.txt
mcule product ID Supplier Catalog Purity (%) Product matching Availability Updated
P-502983363 Innovapharm Screening Compounds 90 in stock August 21, 2017
Property Value
Components 1
Mass 376.403
logP 1.9135
H-bond acceptors 8
H-bond donors 1
Rotatable bonds 8
PSA 96.38
RO5 violations 0
RO3 violations 4
Refractivity 104.576
Atoms 51
Rings 3
Heavy atoms 27
Hydrogen atoms 24
Heteroatoms 8
N/O atoms 8
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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