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P-504268888

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Name File
SDF P-504268888.sdf
SMILES P-504268888.smiles
Standard InChI P-504268888.inchi
InChIKey P-504268888.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-504268888 Innovapharm Virtual Screening Compounds 90 by synthesis
Property Value
Components 1
Mass 285.366
logP 2.13518
H-bond acceptors 4
H-bond donors 1
Rotatable bonds 2
PSA 88.13
RO5 violations 0
RO3 violations 2
Refractivity 84.0247
Atoms 35
Rings 3
Heavy atoms 20
Hydrogen atoms 15
Heteroatoms 5
N/O atoms 4
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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