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P-502705534

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Name File
SDF P-502705534.sdf
SMILES P-502705534.smiles
Standard InChI P-502705534.inchi
InChIKey P-502705534.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502705534 Innovapharm Screening Compounds 90 in stock
Property Value
Components 1
Mass 393.085
logP 6.4143
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 6
PSA 38.33
RO5 violations 1
RO3 violations 3
Refractivity 96.8022
Atoms 36
Rings 2
Heavy atoms 23
Hydrogen atoms 13
Heteroatoms 7
N/O atoms 3
Inorganic atoms 0
Halogen atoms 4
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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