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P-22603004

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Name File
SDF P-22603004.sdf
SMILES P-22603004.smiles
Standard InChI P-22603004.inchi
InChIKey P-22603004.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-22603004 TimTec ActiMol 3 Week 90 in stock April 1, 2014
Property Value
Components 1
Mass 315.120
logP 1.63398
H-bond acceptors 6
H-bond donors 1
Rotatable bonds 5
PSA 92.44
RO5 violations 0
RO3 violations 4
Refractivity 65.5468
Atoms 29
Rings 1
Heavy atoms 18
Hydrogen atoms 11
Heteroatoms 7
N/O atoms 6
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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