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P-580048407

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Name File
SDF P-580048407.sdf
SMILES P-580048407.smiles
Standard InChI P-580048407.inchi
InChIKey P-580048407.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-580048407 Innovapharm Virtual Screening Compounds 90 by synthesis
Property Value
Components 1
Mass 361.397
logP 4.8274
H-bond acceptors 7
H-bond donors 5
Rotatable bonds 6
PSA 136.26
RO5 violations 0
RO3 violations 6
Refractivity 108.0836
Atoms 46
Rings 3
Heavy atoms 27
Hydrogen atoms 19
Heteroatoms 7
N/O atoms 7
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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