Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9975857262-0
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 | 11 USD | 98 | 20 working days | Get Quote |
| 5 mg | 11 USD | 98 | 20 working days | Get Quote |
| 10 mg | 11 USD | 98 | 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.
-
1
MCULE-1053997818-1
- Component type: Main
-
1
MCULE-3504782871-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9975857262-0.sdf |
| SMILES | MCULE-9975857262-0.smiles |
| Standard InChI | MCULE-9975857262-0.inchi |
| InChIKey | MCULE-9975857262-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-616216781 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893230523 | Biosynth | In Stock | 95 | As is | in stock |
| P-870662435 | Glentham Life Sciences | Compounds maintained in stock | 95 | As is | in stock |
| P-855189477 | Toronto Research | In stock | 90 | As is | in stock |
| P-855098234 | Toronto Research | In stock | 90 | As is | in stock |
| P-867403002 | A2B Chem | Predominantly Building Block on demand | N/A | Main component as a main component | by synthesis |
| P-852182830 | A2B Chem | Predominantly Building Block on demand | N/A | Main component as a main component | by synthesis |
| P-852176568 | A2B Chem | Predominantly Building Block on demand | N/A | Main component as a main component | by synthesis |
| P-875744113 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-875784286 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-616216611 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-616209983 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-851830967 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-851951807 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-865917851 | Angene | Building Blocks in stock | 85 | Main component as a main component | 20 g |
| P-619150259 | Angene | Building Blocks in stock | 98 | Main component as a main component | 325 g |
| P-895929028 | Apollo Scientific | On request | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-864306088 | AstaTech | Backordered BBs | 95 | Main component as a main component | by synthesis |
| P-616196963 | BLD pharm | Non-stock building blocks | 85 | Main component as a main component | by synthesis |
| P-893224777 | Biosynth | In Stock | 95 | Main component as a main component | in stock |
| P-868569363 | Combi-Blocks | Building Block in stock | 95 | Main component as a main component | in stock |
| P-862141296 | FluoroChem | General BB | 95 | Main component as a main component | in stock |
| P-675212088 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component as a main component | in stock |
| P-675297782 | Innovapharm | Virtual Building Blocks | 95 | Main component as a main component | by synthesis |
| P-890851881 | Innovapharm | Screening Compounds | 90 | Main component as a main component | in stock |
| P-618003050 | InterBioScreen | Natural Compounds | 92 | Main component as a main component | 300 mg |
| P-889736860 | LabSeeker, Inc | Stock Collection | 99 | Main component as a main component | in stock |
| P-856081387 | LabSeeker, Inc | On demand Catalog | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-895721893 | MedChemExpress | Building Blocks on demand | 95 | Main component as a main component | by synthesis |
| P-881189119 | Otava | In-House Stock Library | 90 | Main component as a main component | 50 mg |
| P-674672761 | Pharmeks LLC | Semi-natural compounds | 92 | Main component as a main component | 300 mg |
| P-675130395 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component as a main component | in stock |
| P-885550657 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component as a main component | by synthesis |
| P-885550658 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component as a main component | by synthesis |
| P-892254218 | TargetMol | Screening Compounds - synthesis | 95 | Main component as a main component | by synthesis |
| P-892296610 | TargetMol | In Stock BB | 95 | Main component as a main component | unavailable |
| P-892339011 | TargetMol | Screening Compounds - stock amount | 95 | Main component as a main component | 3.988 g |
| P-855104901 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-855347296 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-617780583 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component as a main component | 116 mg |
| P-893991865 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| P-666977992 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 194.363 |
| logP | -0.6747 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 122.69 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 27.8661 |
| Atoms | 18 |
| Rings | 0 |
| Heavy atoms | 11 |
| Hydrogen atoms | 7 |
| Heteroatoms | 8 |
| N/O atoms | 6 |
| Inorganic atoms | 1 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
