MCULE-1886325337
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
---|---|---|---|---|
1 mg | 60 USD | 90 | 22 working days | Get Quote |
5 mg | 70 USD | 90 | 22 working days | Get Quote |
10 mg | 74 USD | 95 | 25 working days | Get Quote |
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
-
MCULE-8086979488
- Component type: Main
Name | File |
---|---|
SDF | MCULE-1886325337.sdf |
SMILES | MCULE-1886325337.smiles |
Standard InChI | MCULE-1886325337.inchi |
InChIKey | MCULE-1886325337.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867515860 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-867515862 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-489174607 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-864219744 | AstaTech | Backordered BBs | 97 | As is | by synthesis |
P-492250295 | ChemBridge | Building Block Library | 95 | As is | in stock |
P-872446629 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 50 mg |
P-577179786 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
P-851254946 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-889039431 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-580427050 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-500178284 | J&W Pharmlab | In-stock compounds | 96 | As is | in stock |
P-563495507 | Key Organics | Building Blocks | 97 | As is | 250 mg |
P-854841182 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-611391916 | Toronto Research | In stock | 90 | As is | in stock |
P-886729437 | A2B Chem | Predominantly Building Block in stock | 95 | As a main component | in stock |
P-890028884 | AA Blocks | AA Blocks - synthesis | N/A | As a main component | by synthesis |
P-869371858 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
P-851917511 | AmBeed | On request | N/A | As a main component | by synthesis |
P-889798180 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
P-591115878 | BLD pharm | Non-stock building blocks | 96 | As a main component | by synthesis |
P-500178285 | J&W Pharmlab | In-stock compounds | 96 | As a main component | in stock |
P-854919418 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
P-611609680 | Toronto Research | In stock | 90 | As a main component | in stock |
P-615466562 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 154.235 |
logP | 1.8964 |
H-bond acceptors | 2 |
H-bond donors | 1 |
Rotatable bonds | 1 |
PSA | 53.16 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 46.1037 |
Atoms | 20 |
Rings | 2 |
Heavy atoms | 10 |
Hydrogen atoms | 10 |
Heteroatoms | 3 |
N/O atoms | 2 |
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 |