Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7512825556
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 | 24 USD | 92 | 18 working days | Get Quote |
| 5 mg | 38 USD | 92 | 18 working days | Get Quote |
| 10 mg | 47 USD | 92 | 18 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-7512825556.sdf |
| SMILES | MCULE-7512825556.smiles |
| Standard InChI | MCULE-7512825556.inchi |
| InChIKey | MCULE-7512825556.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867412550 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-612935507 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851831603 | AmBeed | On request | N/A | As is | by synthesis |
| P-596104075 | Asinex | General screening catalog | 90 | As is | 1000 mg |
| P-596484817 | Asinex | General bb catalog | 90 | As is | 1000 mg |
| P-896054318 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-591015664 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-896541236 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-901388938 | FluoroChem | In Stock BB | N/A | As is | 2 g |
| P-488553389 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-13842728 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-596594705 | Key Organics | Building Blocks | 90 | As is | 500 mg |
| P-852383811 | Matrix Scientific | All | N/A | As is | in stock |
| P-895225741 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-454370386 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-23805745 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-579331139 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885529403 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-873236785 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-33595204 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-3133321 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.011 g |
| P-464683465 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.011 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 231.222 |
| logP | 2.5608 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 50.19 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 61.2853 |
| Atoms | 27 |
| Rings | 3 |
| Heavy atoms | 17 |
| Hydrogen atoms | 10 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
