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P-504214801

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Name File
SDF P-504214801.sdf
SMILES P-504214801.smiles
Standard InChI P-504214801.inchi
InChIKey P-504214801.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-504214801 Innovapharm Virtual Screening Compounds 90 by synthesis
Property Value
Components 1
Mass 347.434
logP 2.9233
H-bond acceptors 6
H-bond donors 2
Rotatable bonds 8
PSA 109.38
RO5 violations 0
RO3 violations 4
Refractivity 96.2914
Atoms 45
Rings 2
Heavy atoms 24
Hydrogen atoms 21
Heteroatoms 7
N/O atoms 6
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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