Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7007097093
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 | 77 USD | 95 | 14 working days | Get Quote |
| 5 mg | 77 USD | 95 | 14 working days | Get Quote |
| 10 mg | 126 USD | 95 | 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.
| Name | File |
|---|---|
| SDF | MCULE-7007097093.sdf |
| SMILES | MCULE-7007097093.smiles |
| Standard InChI | MCULE-7007097093.inchi |
| InChIKey | MCULE-7007097093.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-612881712 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-901273479 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-903159319 | Aaron Chemicals LLC | Predominantly Building Block | 95 | As is | 900 mg |
| P-893589498 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 400 mg |
| P-596933192 | Angene | Building Blocks in stock | 95 | As is | 400 mg |
| P-864199704 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-851336982 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-579482315 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-596562493 | Key Organics | Building Blocks | 95 | As is | 100 mg |
| P-895182749 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-584626499 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-888841647 | PharmaBlock | On demand | N/A | As is | by synthesis |
| P-869124847 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-888638548 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-868507603 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 343.488 |
| logP | 4.8864 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 9 |
| PSA | 68.62 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 107.4854 |
| Atoms | 49 |
| Rings | 2 |
| Heavy atoms | 24 |
| Hydrogen atoms | 25 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |
