Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
UNKNOWN STEREO
MCULE-7537131052
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 | 97 USD | 99 | 20 working days | Get Quote |
| 5 mg | 97 USD | 99 | 20 working days | Get Quote |
| 10 mg | 97 USD | 99 | 20 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-8814634396
- Component type: Main
-
MCULE-2343162407
- Component type: Main
-
MCULE-2492357234
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7537131052.sdf |
| SMILES | MCULE-7537131052.smiles |
| Standard InChI | MCULE-7537131052.inchi |
| InChIKey | MCULE-7537131052.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-860615055 | A2B Chem | Predominantly Building Block on demand | 98 | As is | by synthesis |
| P-890161051 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-865922829 | Angene | Building Blocks in stock | 98 | As is | 850 mg |
| P-889452470 | AstaTech | Backordered BBs | 98 | As is | by synthesis |
| P-864304593 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-500373199 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-855294148 | Toronto Research | In stock | 90 | As is | in stock |
| P-886891399 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| P-868506901 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| P-875847624 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-596986048 | Angene | Building Blocks in stock | 99 | As a main component | 750 mg |
| P-864215410 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
| P-445337060 | Pharmeks LLC | Semi-natural compounds | 92 | As a main component | 300 mg |
| P-888644770 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
| P-869136426 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
| P-611521869 | Toronto Research | In stock | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 344.404 |
| logP | 3.3231 |
| H-bond acceptors | 6 |
| H-bond donors | 4 |
| Rotatable bonds | 9 |
| PSA | 90.82 |
| RO5 violations | 0 |
| RO3 violations | 6 |
| Refractivity | 97.4962 |
| Atoms | 49 |
| Rings | 2 |
| Heavy atoms | 25 |
| Hydrogen atoms | 24 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
