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P-504188205

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Name File
SDF P-504188205.sdf
SMILES P-504188205.smiles
Standard InChI P-504188205.inchi
InChIKey P-504188205.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-504188205 Innovapharm Virtual Screening Compounds 90 by synthesis
Property Value
Components 1
Mass 141.214
logP 1.3497
H-bond acceptors 3
H-bond donors 2
Rotatable bonds 1
PSA 53.11
RO5 violations 0
RO3 violations 0
Refractivity 46.7581
Atoms 25
Rings 1
Heavy atoms 10
Hydrogen atoms 15
Heteroatoms 3
N/O atoms 3
Inorganic atoms 0
Halogen atoms 0
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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