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MCULE-3900828019

Compound Show structure
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mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-18790083 Key Organics Screening Compounds and Fragments 90 As is unavailable
P-869076562 MedChemExpress Building Blocks on demand 95 As is by synthesis
Property Value
Components 1
Mass 232.235
logP 0.5913
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 1
PSA 60.85
RO5 violations 0
RO3 violations 2
Refractivity 67.3458
Atoms 29
Rings 3
Heavy atoms 17
Hydrogen atoms 12
Heteroatoms 5
N/O atoms 5
Inorganic atoms 0
Halogen atoms 0
Chiral centers 2
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 2
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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