Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9424377828-0
Structure
Show compound
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 | 39 USD | 95 | 9 working days | Get Quote |
| 5 mg | 44 USD | 95 | 16 working days | Get Quote |
| 10 mg | 74 USD | 95 | 16 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.
-
1
MCULE-1911638043-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9424377828-0.sdf |
| SMILES | MCULE-9424377828-0.smiles |
| Standard InChI | MCULE-9424377828-0.inchi |
| InChIKey | MCULE-9424377828-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-480862253 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
| P-867610921 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
| P-875770349 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-612936274 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-489148844 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component | in stock |
| P-872726087 | Apexbio Technology | Bioactive Compound Library | 98 | Main component | in stock |
| P-864087148 | AstaTech | In Stock BBs | 97 | Main component | in stock |
| P-851243152 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-580450263 | CliniSciences S.A.S | All products | 98 | Main component | in stock |
| P-889434799 | FluoroChem | General BB | N/A | Main component | in stock |
| P-870661670 | Glentham Life Sciences | Compounds typically in stock | N/A | Main component | in stock |
| P-675214981 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component | in stock |
| P-855960894 | Key Organics | Building Blocks | 97 | Main component | 100 mg |
| P-852466612 | Matrix Scientific | All | N/A | Main component | in stock |
| P-854721291 | MedChemExpress | Screening compounds In stock | 95 | Main component | in stock |
| P-584625011 | MedKoo | In stock compounds | 95 | Main component | in stock |
| P-878645573 | Molnova | Stock | 98 | Main component | in stock |
| P-869120841 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-892289594 | TargetMol | In Stock BB | 95 | Main component | unavailable |
| P-888635585 | TargetMol | Screening Compounds - stock amount | 95 | Main component | 143 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 514.029 |
| logP | 6.2229 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 5 |
| PSA | 65.85 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 143.79 |
| Atoms | 61 |
| Rings | 5 |
| Heavy atoms | 35 |
| Hydrogen atoms | 26 |
| Heteroatoms | 8 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
