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  1. InChIKey:
  2. SMILES:
  3. Formula:
Amount Price  Help
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1 mg 34 USD 90 17 working days Get Quote
5 mg 35 USD 90 17 working days Get Quote
10 mg 41 USD 90 17 working days Get Quote
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    1. MCULE-8413316391

    2. Component type: Main
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-855960819 Key Organics Building Blocks 97 As is 100 mg
P-881188571 Otava In-House Stock Library 90 As is 50 mg
P-617326182 Alinda Stock Screening Compounds 90 As a main component in stock
P-580759972 Crea-Chim HTS compounds 90 As a main component in stock
P-505497292 Hangzhou Apichem Building Blocks in stock 95 As a main component in stock
P-885541536 Princeton Biomolecular Research Building Blocks Synthesis 95 As a main component by synthesis
P-869120864 TargetMol Screening Compounds - stock amount 95 As a main component 22.742 g
P-617794052 VITAS M CHEMICAL LIMITED Screening compounds 90 As a main component 186 mg
Property Value
Components 1
Mass 586.182
logP 8.948
H-bond acceptors 4
H-bond donors 2
Rotatable bonds 12
PSA 95.72
RO5 violations 2
RO3 violations 5
Refractivity 172.6456
Atoms 77
Rings 5
Heavy atoms 41
Hydrogen atoms 36
Heteroatoms 6
N/O atoms 4
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 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0