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  1. InChIKey:
  2. SMILES:
  3. Formula:
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1 mg 72 USD 95 10 working days Get Quote
5 mg 72 USD 95 10 working days Get Quote
10 mg 72 USD 95 10 working days Get Quote
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    1. MCULE-4054268395

    2. Component type: Main
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-504487701 Innovapharm Virtual Screening Compounds 90 As is by synthesis August 21, 2017
P-502458079 Innovapharm Virtual Building Blocks 95 As is by synthesis August 21, 2017
P-491385604 Princeton Biomolecular Research Building Block Libraries 95 As is in stock August 1, 2017
P-611113665 BLD pharm Non-stock building blocks 98 As a main component by synthesis June 29
P-616416404 Enamine Functional Collection 90 As a main component in stock December 5, 2020
P-618674873 Enamine Stock Building Blocks 95 As a main component in stock May 1
P-611400491 Toronto Research In stock N/A As a main component in stock June 25, 2020
P-601645305 Ukrorgsyntez Stock Screening Compounds 90 As a main component in stock February 1, 2020
Property Value
Components 1
Mass 280.772
logP 0.5131
H-bond acceptors 5
H-bond donors 0
Rotatable bonds 3
PSA 66.07
RO5 violations 0
RO3 violations 2
Refractivity 73.538
Atoms 34
Rings 2
Heavy atoms 17
Hydrogen atoms 17
Heteroatoms 7
N/O atoms 5
Inorganic atoms 0
Halogen atoms 1
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