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P-502540707

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Name File
SDF P-502540707.sdf
SMILES P-502540707.smiles
Standard InChI P-502540707.inchi
InChIKey P-502540707.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502540707 Innovapharm Virtual Building Blocks 95 by synthesis
Property Value
Components 1
Mass 362.253
logP 3.6072
H-bond acceptors 4
H-bond donors 1
Rotatable bonds 4
PSA 115.0
RO5 violations 0
RO3 violations 5
Refractivity 92.6388
Atoms 30
Rings 2
Heavy atoms 21
Hydrogen atoms 9
Heteroatoms 8
N/O atoms 4
Inorganic atoms 0
Halogen atoms 2
Chiral centers 0
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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