Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9646714520
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 | 5 USD | 98 | 8 working days | Get Quote |
| 5 mg | 5 USD | 98 | 8 working days | Get Quote |
| 10 mg | 5 USD | 98 | 8 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.
| Name | File |
|---|---|
| SDF | MCULE-9646714520.sdf |
| SMILES | MCULE-9646714520.smiles |
| Standard InChI | MCULE-9646714520.inchi |
| InChIKey | MCULE-9646714520.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867632690 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-867412729 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-875797359 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590418885 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-34875813 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-436452445 | Alinda | Building Blocks | 95 | As is | 50 g |
| P-606902378 | AmBeed | In stock | N/A | As is | in stock |
| P-596933115 | Angene | Building Blocks in stock | 98 | As is | 1.399 kg |
| P-864100125 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-481170105 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 5 g |
| P-580712972 | BLD pharm | In-stock building blocks | 98 | As is | 797.25 g |
| P-851279728 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868603064 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-580429101 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862021752 | FluoroChem | General BB | 95 | As is | in stock |
| P-870646414 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-870648813 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-590342469 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 2.09 g |
| P-890219679 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-854062904 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-13748355 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-524163589 | Key Organics | Building Blocks | 98 | As is | 100 g |
| P-524163588 | Key Organics | Building Blocks | 98 | As is | 100 g |
| P-524185713 | Key Organics | Building Blocks | 98 | As is | 10 g |
| P-855996224 | Key Organics | Screening Compounds and Fragments | 98 | As is | 100 mg |
| P-855992503 | Key Organics | Screening Compounds and Fragments | 98 | As is | 100 mg |
| P-855992504 | Key Organics | Screening Compounds and Fragments | 98 | As is | 100 mg |
| P-579611331 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-579611648 | LabSeeker, Inc | Stock Collection | 97 | As is | in stock |
| P-856043811 | LaboTest | Building Blocks | 90 | As is | 500 mg |
| P-31179452 | LaboTest | Screening Collection | 90 | As is | 500 mg |
| P-588250701 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852406513 | Matrix Scientific | All | N/A | As is | in stock |
| P-852551513 | Matrix Scientific | All | N/A | As is | in stock |
| P-878643529 | Molnova | Stock | 98 | As is | in stock |
| P-617711511 | Otava | Chemical Building Blocks for Prompt Delivery | 97 | As is | 500 mg |
| P-26596028 | Otava | In-House Stock Library | 90 | As is | 500 mg |
| P-868099545 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-14040675 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-424823804 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885517292 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-892262579 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892343957 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-22458428 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 69 mg |
| P-611380440 | Toronto Research | In stock | 90 | As is | in stock |
| P-1428343 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 4.193 g |
| P-464675037 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 4.193 g |
| P-893990257 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-893902051 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 249.262 |
| logP | 1.8101 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 66.84 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 68.3928 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 15 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
