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MCULE-6712849045

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mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502695101 Innovapharm Screening Compounds 90 As is in stock
P-22720466 TimTec ActiMol 3 Week 90 As is in stock
Property Value
Components 1
Mass 178.217
logP 1.6168
H-bond acceptors 4
H-bond donors 1
Rotatable bonds 2
PSA 82.17
RO5 violations 0
RO3 violations 2
Refractivity 47.9557
Atoms 18
Rings 2
Heavy atoms 12
Hydrogen atoms 6
Heteroatoms 5
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 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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