Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3733285418
Compound
Show structure
In order to add this molecule to a collection you have to create an account.
Sign up for free
- 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 | 70 USD | 90 | 30 working days | Get Quote |
| 5 mg | 82 USD | 90 | 30 working days | Get Quote |
| 10 mg | 87 USD | 97 | 14 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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-6680297741
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3733285418.sdf |
| SMILES | MCULE-3733285418.smiles |
| Standard InChI | MCULE-3733285418.inchi |
| InChIKey | MCULE-3733285418.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867401003 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-612940727 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-489202907 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-851288720 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-887967044 | Combi-Blocks | Building Block in stock | 96 | As is | in stock |
| P-580410134 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-579523186 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 1 mg |
| P-890211995 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-502548229 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-500152777 | J&W Pharmlab | In-stock compounds | 97 | As is | in stock |
| P-524175501 | Key Organics | Building Blocks | 95 | As is | unavailable |
| P-893944979 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-867633597 | A2B Chem | Predominantly Building Block in stock | 95 | As a main component | in stock |
| P-875798383 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-590373623 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-610980126 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As a main component | 49.95 g |
| P-875897252 | Allbio Pharm | In stock | N/A | As a main component | in stock |
| P-489126166 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As a main component | in stock |
| P-868830696 | Angene | Building Blocks in stock | 99 | As a main component | 15 g |
| P-895941911 | Apollo Scientific | On request | 95 | As a main component | by resynthesis (? - ? days) |
| P-864089191 | AstaTech | In Stock BBs | 97 | As a main component | in stock |
| P-893332347 | BioBlocks | In stock | 95 | As a main component | in stock |
| P-851243922 | Chemshuttle | On request catalog | 95 | As a main component | by synthesis |
| P-868650033 | Combi-Blocks | Building Block in stock | 98 | As a main component | in stock |
| P-580340757 | Debye Scientific | General Catalog | 95 | As a main component | by resynthesis (? - ? days) |
| P-862019533 | FluoroChem | General BB | 95 | As a main component | in stock |
| P-500152778 | J&W Pharmlab | In-stock compounds | 97 | As a main component | in stock |
| P-563465396 | Key Organics | Building Blocks | 97 | As a main component | 250 mg |
| P-852502909 | Matrix Scientific | All | N/A | As a main component | in stock |
| P-611602904 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-893944975 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 179.215 |
| logP | 1.6747 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 52.32 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 50.2019 |
| Atoms | 26 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 13 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
