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  1. InChIKey:
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Name File
SDF P-675336414.sdf
SMILES P-675336414.smiles
Standard InChI P-675336414.inchi
InChIKey P-675336414.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-675336414 Innovapharm Virtual Building Blocks 95 by synthesis
Property Value
Components 1
Mass 187.236
logP 1.5485
H-bond acceptors 4
H-bond donors 2
Rotatable bonds 8
PSA 66.4
RO5 violations 0
RO3 violations 3
Refractivity 50.1505
Atoms 30
Rings 0
Heavy atoms 13
Hydrogen atoms 17
Heteroatoms 4
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