Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1261809157-0
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 | 6 USD | N/A | 9 working days | Get Quote |
| 5 mg | 6 USD | N/A | 9 working days | Get Quote |
| 10 mg | 6 USD | N/A | 9 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-1868494404-2
- Component type: Main
-
2
MCULE-5932450224-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1261809157-0.sdf |
| SMILES | MCULE-1261809157-0.smiles |
| Standard InChI | MCULE-1261809157-0.inchi |
| InChIKey | MCULE-1261809157-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892877286 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-890019690 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-590366410 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-851665110 | AmBeed | On request | N/A | As is | by synthesis |
| P-865931121 | Angene | Building Blocks in stock | 98 | As is | 5 kg |
| P-869398428 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-868571212 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-854804512 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-886893627 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-867565193 | A2B Chem | Predominantly Building Block in stock | 98 | Main component as a main component | in stock |
| P-875724547 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-869239172 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-891665790 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-606856548 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-596946755 | Angene | Building Blocks in stock | 98 | Main component as a main component | 5 kg |
| P-895956956 | Apollo Scientific | In Stock | 95 | Main component as a main component | 4 kg |
| P-893229299 | Biosynth | In Stock | 95 | Main component as a main component | in stock |
| P-868627847 | Combi-Blocks | Building Block in stock | 97 | Main component as a main component | in stock |
| P-862094554 | FluoroChem | General BB | 95 | Main component as a main component | in stock |
| P-890850432 | Innovapharm | Building Blocks | 95 | Main component as a main component | in stock |
| P-608111552 | LabSeeker, Inc | Stock Collection | N/A | Main component as a main component | in stock |
| P-580500414 | Manchester Organics | Compounds on demand | N/A | Main component as a main component | by synthesis |
| P-899991594 | MedChemExpress | Screening compounds on demand | 95 | Main component as a main component | by synthesis |
| P-650819942 | Otava | Tangible screening compounds | 90 | Main component as a main component | by synthesis |
| P-26464443 | Otava | In-House Stock Library | 90 | Main component as a main component | 2.7 g |
| P-596770724 | Synthonix | In-stock Building Blocks | 95 | Main component as a main component | 297.523 kg |
| P-855060572 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-893996229 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 368.423 |
| logP | -4.7406 |
| H-bond acceptors | 10 |
| H-bond donors | 2 |
| Rotatable bonds | 11 |
| PSA | 161.34 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 59.1786 |
| Atoms | 36 |
| Rings | 0 |
| Heavy atoms | 22 |
| Hydrogen atoms | 14 |
| Heteroatoms | 12 |
| N/O atoms | 10 |
| Inorganic atoms | 2 |
| 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 |
