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P-854621324

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Name File
SDF P-854621324.sdf
SMILES P-854621324.smiles
Standard InChI P-854621324.inchi
InChIKey P-854621324.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-854621324 Excenen Excenen compounds 98 in stock
Property Value
Components 1
Mass 1002.641
logP 6.1428
H-bond acceptors 17
H-bond donors 4
Rotatable bonds 25
PSA 267.97
RO5 violations 3
RO3 violations 6
Refractivity 272.8339
Atoms 129
Rings 7
Heavy atoms 69
Hydrogen atoms 60
Heteroatoms 20
N/O atoms 17
Inorganic atoms 0
Halogen atoms 1
Chiral centers 4
R/S chiral centers 4
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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