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P-895188884

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Name File
SDF P-895188884.sdf
SMILES P-895188884.smiles
Standard InChI P-895188884.inchi
InChIKey P-895188884.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-895188884 MedChemExpress Screening compounds on demand 95 by synthesis
Property Value
Components 2
Mass 464.898
logP 5.0214
H-bond acceptors 8
H-bond donors 3
Rotatable bonds 7
PSA 125.3
RO5 violations 1
RO3 violations 5
Refractivity 126.2253
Atoms 54
Rings 4
Heavy atoms 33
Hydrogen atoms 21
Heteroatoms 9
N/O atoms 8
Inorganic atoms 0
Halogen atoms 1
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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