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P-580046057

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Name File
SDF P-580046057.sdf
SMILES P-580046057.smiles
Standard InChI P-580046057.inchi
InChIKey P-580046057.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-580046057 Innovapharm Screening Compounds 90 in stock
Property Value
Components 1
Mass 360.472
logP 4.2719
H-bond acceptors 5
H-bond donors 0
Rotatable bonds 3
PSA 67.76
RO5 violations 0
RO3 violations 4
Refractivity 98.7395
Atoms 49
Rings 3
Heavy atoms 25
Hydrogen atoms 24
Heteroatoms 6
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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