Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8259942199
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 | 51 USD | 95 | 19 working days | Get Quote |
| 5 mg | 101 USD | 95 | 19 working days | Get Quote |
| 10 mg | 170 USD | 95 | 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-6884631109
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8259942199.sdf |
| SMILES | MCULE-8259942199.smiles |
| Standard InChI | MCULE-8259942199.inchi |
| InChIKey | MCULE-8259942199.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-890187955 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-489241221 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-861371406 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-608494681 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-870660521 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-888624569 | Key Organics | Building Blocks | 95 | As is | 1 mg |
| P-584616265 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-888170648 | Molnova | On demand | 98 | As is | by synthesis |
| P-878644468 | Molnova | Stock | 98 | As is | in stock |
| P-873283347 | Shanghai iChemical | In stock | N/A | As is | in stock |
| P-888659446 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869164226 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-596714460 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 4 mg |
| P-869257325 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-864262113 | AstaTech | Backordered BBs | 98 | As a main component | by synthesis |
| P-855926632 | Key Organics | Building Blocks | 97 | As a main component | 100 mg |
| P-854714615 | MedChemExpress | Screening compounds In stock | 95 | As a main component | in stock |
| P-888633502 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
| P-869118439 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 417.542 |
| logP | 4.5744 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 9 |
| PSA | 44.81 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 133.6382 |
| Atoms | 62 |
| Rings | 4 |
| Heavy atoms | 31 |
| Hydrogen atoms | 31 |
| 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 |
