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P-504608649

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Name File
SDF P-504608649.sdf
SMILES P-504608649.smiles
Standard InChI P-504608649.inchi
InChIKey P-504608649.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-504608649 Innovapharm Virtual Screening Compounds 90 by synthesis
Property Value
Components 1
Mass 175.237
logP 0.8582
H-bond acceptors 4
H-bond donors 1
Rotatable bonds 2
PSA 121.92
RO5 violations 0
RO3 violations 2
Refractivity 41.4737
Atoms 15
Rings 1
Heavy atoms 10
Hydrogen atoms 5
Heteroatoms 6
N/O atoms 4
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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