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P-449250845

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1 mg 89 USD 90 12 working days Get Quote
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Name File
SDF P-449250845.sdf
SMILES P-449250845.smiles
Standard InChI P-449250845.inchi
InChIKey P-449250845.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-449250845 ChemDiv Discovery Chemistry Library 90 3 mg
Property Value
Components 1
Mass 465.494
logP 3.3493
H-bond acceptors 8
H-bond donors 1
Rotatable bonds 9
PSA 102.37
RO5 violations 0
RO3 violations 5
Refractivity 127.2828
Atoms 61
Rings 4
Heavy atoms 34
Hydrogen atoms 27
Heteroatoms 8
N/O atoms 8
Inorganic atoms 0
Halogen atoms 0
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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