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P-502602692

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Name File
SDF P-502602692.sdf
SMILES P-502602692.smiles
Standard InChI P-502602692.inchi
InChIKey P-502602692.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502602692 Innovapharm Screening Compounds 90 in stock
Property Value
Components 1
Mass 367.394
logP 2.8632
H-bond acceptors 6
H-bond donors 2
Rotatable bonds 6
PSA 87.07
RO5 violations 0
RO3 violations 4
Refractivity 104.0343
Atoms 48
Rings 3
Heavy atoms 27
Hydrogen atoms 21
Heteroatoms 6
N/O atoms 6
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 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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