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P-504588551

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Name File
SDF P-504588551.sdf
SMILES P-504588551.smiles
Standard InChI P-504588551.inchi
InChIKey P-504588551.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-504588551 Innovapharm Virtual Screening Compounds 90 by synthesis
Property Value
Components 1
Mass 314.342
logP 0.0177
H-bond acceptors 8
H-bond donors 0
Rotatable bonds 3
PSA 77.55
RO5 violations 0
RO3 violations 3
Refractivity 88.593
Atoms 41
Rings 4
Heavy atoms 23
Hydrogen atoms 18
Heteroatoms 8
N/O atoms 8
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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