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P-502343773

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Name File
SDF P-502343773.sdf
SMILES P-502343773.smiles
Standard InChI P-502343773.inchi
InChIKey P-502343773.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502343773 TimTec Building Block Collection 90 in stock
Property Value
Components 1
Mass 174.583
logP 0.866
H-bond acceptors 4
H-bond donors 0
Rotatable bonds 3
PSA 44.12
RO5 violations 0
RO3 violations 1
Refractivity 39.5645
Atoms 18
Rings 1
Heavy atoms 11
Hydrogen atoms 7
Heteroatoms 5
N/O atoms 4
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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