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P-502818320

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Name File
SDF P-502818320.sdf
SMILES P-502818320.smiles
Standard InChI P-502818320.inchi
InChIKey P-502818320.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502818320 Innovapharm Screening Compounds 90 in stock
Property Value
Components 1
Mass 310.774
logP 3.1579
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 6
PSA 58.64
RO5 violations 0
RO3 violations 4
Refractivity 85.7847
Atoms 40
Rings 2
Heavy atoms 21
Hydrogen atoms 19
Heteroatoms 6
N/O atoms 5
Inorganic atoms 0
Halogen atoms 1
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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