Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7512792589
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 | 36 USD | 90 | 19 working days | Get Quote |
| 5 mg | 47 USD | 98 | 19 working days | Get Quote |
| 10 mg | 47 USD | 98 | 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.
-
MCULE-1389248075
- Component type: Main
-
MCULE-7744406566
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7512792589.sdf |
| SMILES | MCULE-7512792589.smiles |
| Standard InChI | MCULE-7512792589.inchi |
| InChIKey | MCULE-7512792589.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-893163710 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-867453974 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-505391320 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-504649045 | ChemBridge | RUSH - EXPRESS PICK LIBRARY | 90 | As is | 5 mg |
| P-899783402 | Key Organics | Building Blocks | 97 | As is | 5 mg |
| P-892254578 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892339239 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-505403885 | AK Scientific | Building Blocks | 98 | As a main component | in stock |
| P-505395945 | AK Scientific | Building Blocks | 98 | As a main component | in stock |
| P-872725862 | Apexbio Technology | Bioactive Compound Library | 98 | As a main component | in stock |
| P-870661149 | Glentham Life Sciences | Compounds typically in stock | 99 | As a main component | in stock |
| P-505500653 | Hangzhou Apichem | Building Blocks in stock | 95 | As a main component | in stock |
| P-488555467 | InterBioScreen | Bioactive compounds | 92 | As a main component | in stock |
| P-524164516 | Key Organics | Building Blocks | 98 | As a main component | 100 mg |
| P-13792475 | Pharmeks LLC | Synthetic compounds | 92 | As a main component | 300 mg |
| P-889869105 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As a main component | by synthesis |
| P-869126263 | TargetMol | Screening Compounds - synthesis | 95 | As a main component | by synthesis |
| P-888639668 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | unavailable |
| P-611434061 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-855241440 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-855067113 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-617773612 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As a main component | 128 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 278.391 |
| logP | 3.8554 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 16.13 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 92.513 |
| Atoms | 43 |
| Rings | 3 |
| Heavy atoms | 21 |
| Hydrogen atoms | 22 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
