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P-502371087

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Name File
SDF P-502371087.sdf
SMILES P-502371087.smiles
Standard InChI P-502371087.inchi
InChIKey P-502371087.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502371087 TimTec Building Block Collection 90 in stock
Property Value
Components 1
Mass 223.225
logP 1.7784
H-bond acceptors 5
H-bond donors 2
Rotatable bonds 7
PSA 75.63
RO5 violations 0
RO3 violations 3
Refractivity 56.8835
Atoms 29
Rings 1
Heavy atoms 16
Hydrogen atoms 13
Heteroatoms 5
N/O atoms 5
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 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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