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P-502739211

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Name File
SDF P-502739211.sdf
SMILES P-502739211.smiles
Standard InChI P-502739211.inchi
InChIKey P-502739211.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502739211 Innovapharm Screening Compounds 90 in stock
Property Value
Components 1
Mass 304.385
logP 4.7944
H-bond acceptors 3
H-bond donors 2
Rotatable bonds 1
PSA 41.13
RO5 violations 0
RO3 violations 2
Refractivity 99.7504
Atoms 43
Rings 4
Heavy atoms 23
Hydrogen atoms 20
Heteroatoms 3
N/O atoms 3
Inorganic atoms 0
Halogen atoms 0
Chiral centers 2
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 2
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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