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P-12745283

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Name File
SDF P-12745283.sdf
SMILES P-12745283.smiles
Standard InChI P-12745283.inchi
InChIKey P-12745283.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-12745283 InterBioScreen Screening Compounds 92 unavailable
Property Value
Components 1
Mass 396.260
logP 5.0408
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 10
PSA 64.63
RO5 violations 1
RO3 violations 5
Refractivity 102.4882
Atoms 45
Rings 2
Heavy atoms 26
Hydrogen atoms 19
Heteroatoms 7
N/O atoms 5
Inorganic atoms 0
Halogen atoms 2
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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