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P-502532198

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Name File
SDF P-502532198.sdf
SMILES P-502532198.smiles
Standard InChI P-502532198.inchi
InChIKey P-502532198.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-502532198 Innovapharm Virtual Building Blocks 95 by synthesis August 21, 2017
Property Value
Components 1
Mass 327.334
logP 1.3447
H-bond acceptors 7
H-bond donors 1
Rotatable bonds 5
PSA 86.21
RO5 violations 0
RO3 violations 4
Refractivity 90.1637
Atoms 41
Rings 3
Heavy atoms 24
Hydrogen atoms 17
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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