MCULE-6550730089
- 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 | 21 USD | 95 | 14 working days | Get Quote |
5 mg | 21 USD | 95 | 14 working days | Get Quote |
10 mg | 21 USD | 95 | 14 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-9022050616
- Component type: Main
-
MCULE-2998034626
- Component type: Main
Name | File |
---|---|
SDF | MCULE-6550730089.sdf |
SMILES | MCULE-6550730089.smiles |
Standard InChI | MCULE-6550730089.inchi |
InChIKey | MCULE-6550730089.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-875721835 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-611623198 | AK Scientific | Building Blocks | 97 | As is | in stock |
P-893578945 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 73.467 g |
P-606896837 | AmBeed | In stock | N/A | As is | in stock |
P-489146061 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-596992197 | Angene | Building Blocks in stock | 98 | As is | 10 g |
P-552049042 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-864179137 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-590623436 | BLD pharm | In-stock building blocks | 98 | As is | 30.055 g |
P-851315608 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-887224459 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-580435882 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-862041733 | FluoroChem | General BB | 95 | As is | in stock |
P-596564149 | Key Organics | Building Blocks | 95 | As is | 100 mg |
P-615655200 | LabNetwork | In stock | 95 | As is | in stock |
P-855397400 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
P-888878031 | PharmaBlock | In stock | N/A | As is | in stock |
P-889875936 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-886955408 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
P-867669904 | A2B Chem | Predominantly Building Block in stock | 95 | As a main component | in stock |
P-875843937 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
P-851757030 | AmBeed | On request | N/A | As a main component | by synthesis |
P-611191364 | BLD pharm | Non-stock building blocks | 97 | As a main component | by synthesis |
P-492259125 | ChemBridge | Building Block Library | 95 | As a main component | in stock |
P-861374717 | Combi-Blocks | Building Block on demand | 95 | As a main component | by synthesis |
P-855951035 | Key Organics | Building Blocks | 95 | As a main component | 1000 mg |
P-893667706 | eNovation Chemicals LLC | Building Block on demand | 95 | As a main component | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 158.199 |
logP | 3.1666 |
H-bond acceptors | 2 |
H-bond donors | 2 |
Rotatable bonds | 0 |
PSA | 52.04 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 52.7568 |
Atoms | 22 |
Rings | 2 |
Heavy atoms | 12 |
Hydrogen atoms | 10 |
Heteroatoms | 2 |
N/O atoms | 2 |
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 | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |