Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3049117865-0
Structure
Show compound
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 | 10 USD | 98 | 15 working days | Get Quote |
| 5 mg | 19 USD | 98 | 15 working days | Get Quote |
| 10 mg | 19 USD | 98 | 15 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-9567672915-0
- Component type: Main
-
MCULE-6001636249-0
- Component type: Main
-
MCULE-1277665140-0
- Component type: Main
-
MCULE-4777649891-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3049117865-0.sdf |
| SMILES | MCULE-3049117865-0.smiles |
| Standard InChI | MCULE-3049117865-0.inchi |
| InChIKey | MCULE-3049117865-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892876351 | A2B Chem | Predominantly Building Block in stock | 10 | As is | in stock |
| P-890179897 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-903285015 | Aaron Chemicals LLC | Predominantly Building Block | 95 | As is | 1000 mg |
| P-893606767 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 410 mg |
| P-851617147 | AmBeed | On request | N/A | As is | by synthesis |
| P-868832480 | Angene | Building Blocks in stock | 10 | As is | 1000 mg |
| P-889849522 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590972802 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-448677953 | ChemDiv | Discovery Chemistry Library | 90 | As is | 743 mg |
| P-425206422 | Chemical Intelligence Co Limited | Stock Screening Compounds | 90 | As is | in stock |
| P-887322407 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-524444715 | Key Organics | Biochemicals | 97 | As is | 8.445 g |
| P-899992503 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-885536164 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-869131194 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892291959 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888642514 | TargetMol | Screening Compounds - stock amount | 95 | As is | 15 mg |
| P-903627485 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-611452254 | Toronto Research | In stock | 90 | As is | in stock |
| P-894010891 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-893145927 | A2B Chem | Predominantly Building Block on demand | N/A | As a main component | by synthesis |
| P-893184457 | A2B Chem | Predominantly Building Block on demand | N/A | As a main component | by synthesis |
| P-875725506 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-881673345 | AK Scientific | Building Blocks | 98 | As a main component | in stock |
| P-903054657 | Aaron Chemicals LLC | Predominantly Building Block | 99 | As a main component | 50 g |
| P-904319999 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As a main component | 50.6 g |
| P-851517868 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-606855534 | AmBeed | In stock | N/A | As a main component | in stock |
| P-596947036 | Angene | Building Blocks in stock | 98 | As a main component | 50 g |
| P-864161066 | AstaTech | In Stock BBs | 95 | As a main component | in stock |
| P-580700685 | BLD pharm | In-stock building blocks | 98 | As a main component | 238 mg |
| P-615689669 | BLD pharm | Non-stock building blocks | 97 | As a main component | by synthesis |
| P-901467214 | Biosynth | Synthesis | 95 | As a main component | by synthesis |
| P-901467215 | Biosynth | Synthesis | 95 | As a main component | by synthesis |
| P-893226340 | Biosynth | In Stock | 95 | As a main component | in stock |
| P-851278632 | Chemshuttle | On request catalog | 95 | As a main component | by synthesis |
| P-580452765 | CliniSciences S.A.S | All products | 98 | As a main component | in stock |
| P-861514249 | Combi-Blocks | Building Block on demand | 95 | As a main component | by synthesis |
| P-901409748 | FluoroChem | General BB | N/A | As a main component | in stock |
| P-873248898 | Key Organics | Building Blocks | 97 | As a main component | 10 mg |
| P-873248899 | Key Organics | Building Blocks | 97 | As a main component | 10 mg |
| P-524440299 | Key Organics | Biochemicals | 97 | As a main component | 9.736 g |
| P-856034170 | LaboTest | Screening Collection | 90 | As a main component | 10 g |
| P-854712135 | MedChemExpress | Screening compounds In stock | 95 | As a main component | in stock |
| P-904058791 | MedChemExpress | Screening compounds on demand | 95 | As a main component | by synthesis |
| P-895196788 | MedChemExpress | Screening compounds on demand | 95 | As a main component | by synthesis |
| P-896628322 | MedChemExpress | Screening compounds on demand | 95 | As a main component | by synthesis |
| P-474026141 | MedKoo | In stock compounds | 95 | As a main component | in stock |
| P-675100719 | Princeton Biomolecular Research | Screening Compounds | 90 | As a main component | in stock |
| P-579711798 | Selleck Biotechnology GmbH | Product Catalog | N/A | As a main component | in stock |
| P-904221903 | TargetMol | Screening Compounds - synthesis | 95 | As a main component | by synthesis |
| P-904238622 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | unavailable |
| P-502365859 | TimTec | Building Block Collection | 90 | As a main component | in stock |
| P-617724199 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As a main component | 1.458 g |
| P-617780735 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As a main component | 1.458 g |
| P-666966517 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 399.955 |
| logP | 6.0454 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 9 |
| PSA | 37.39 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 121.4087 |
| Atoms | 58 |
| Rings | 3 |
| Heavy atoms | 28 |
| Hydrogen atoms | 30 |
| Heteroatoms | 5 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
