Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6996712967
Compound
Show structures
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 | 35 USD | 90 | 19 working days | Get Quote |
| 5 mg | 51 USD | 90 | 19 working days | Get Quote |
| 10 mg | 64 USD | 90 | 19 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-6996712967.sdf |
| SMILES | MCULE-6996712967.smiles |
| Standard InChI | MCULE-6996712967.inchi |
| InChIKey | MCULE-6996712967.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867306627 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-889928949 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-893456149 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 6.542 g |
| P-851785447 | AmBeed | On request | N/A | As is | by synthesis |
| P-591123360 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-454758699 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-874549940 | ChemDiv | Discovery Chemistry Library | 90 | As is | unavailable |
| P-34525696 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-580767523 | Crea-Chim | Prepacked BB compounds with prompt delivery | 90 | As is | in stock |
| P-580778285 | Crea-Chim | Building Blocks | 90 | As is | by resynthesis (? - ? days) |
| P-580439523 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-575337407 | EvoBlocks | In-stock Building Blocks | 95 | As is | in stock |
| P-861946303 | FluoroChem | General BB | 95 | As is | in stock |
| P-579498007 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 100 mg |
| P-890207932 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-14043541 | InFarmatik | Building Blocks | 90 | As is | no data |
| P-492226471 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-488554465 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-427867112 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-596598048 | Key Organics | Building Blocks | 90 | As is | 1000 mg |
| P-467979455 | Life Chemicals | Building Blocks | 95 | As is | 5.537 g |
| P-601067761 | Life Chemicals | Screening Compounds | 90 | As is | 5.537 g |
| P-580495328 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-580467063 | Manchester Organics | Compounds on demand | 95 | As is | by synthesis |
| P-852507516 | Matrix Scientific | All | N/A | As is | in stock |
| P-895331311 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-454375015 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-445286503 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-23869263 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-454187235 | Specs | Screening Compounds | 90 | As is | 52 mg |
| P-502333434 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22500624 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 10 mg |
| P-855212689 | Toronto Research | In stock | 90 | As is | in stock |
| P-1175615 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 165 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 232.235 |
| logP | 1.8719 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 64.21 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 61.7952 |
| Atoms | 29 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 12 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
