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P-608274590

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Name File
SDF P-608274590.sdf
SMILES P-608274590.smiles
Standard InChI P-608274590.inchi
InChIKey P-608274590.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-608274590 Molnova Stock 98 in stock
Property Value
Components 2
Mass 432.494
logP 0.6702
H-bond acceptors 11
H-bond donors 4
Rotatable bonds 9
PSA 182.58
RO5 violations 1
RO3 violations 5
Refractivity 109.3831
Atoms 57
Rings 2
Heavy atoms 29
Hydrogen atoms 28
Heteroatoms 12
N/O atoms 11
Inorganic atoms 0
Halogen atoms 0
Chiral centers 1
R/S chiral centers 1
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 1
Cis/trans stereo double bonds 1
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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