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P-14701613

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Name File
SDF P-14701613.sdf
SMILES P-14701613.smiles
Standard InChI P-14701613.inchi
InChIKey P-14701613.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-14701613 Life Chemicals Screening Compounds 90 in stock
Property Value
Components 1
Mass 434.936
logP 3.4892
H-bond acceptors 6
H-bond donors 0
Rotatable bonds 5
PSA 75.3
RO5 violations 0
RO3 violations 5
Refractivity 120.162
Atoms 52
Rings 4
Heavy atoms 29
Hydrogen atoms 23
Heteroatoms 8
N/O atoms 6
Inorganic atoms 0
Halogen atoms 1
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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