Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6881896862-0
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 | 7 USD | 98 | 20 working days | Get Quote |
| 5 mg | 7 USD | 98 | 20 working days | Get Quote |
| 10 mg | 7 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-8370963604-0
- Component type: Main
-
1
MCULE-4467353796-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6881896862-0.sdf |
| SMILES | MCULE-6881896862-0.smiles |
| Standard InChI | MCULE-6881896862-0.inchi |
| InChIKey | MCULE-6881896862-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-890141019 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-890228381 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-861471297 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-869070087 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-868501730 | eNovation Chemicals LLC | Building Blocks in stock | 85 | As is | in stock |
| P-674971603 | A2B Chem | Predominantly Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-852103032 | A2B Chem | Predominantly Building Block on demand | 96 | Main component as a main component | by synthesis |
| P-867589581 | A2B Chem | Predominantly Building Block in stock | 98 | Main component as a main component | in stock |
| P-867589497 | A2B Chem | Predominantly Building Block in stock | 98 | Main component as a main component | in stock |
| P-867606752 | A2B Chem | Predominantly Building Block in stock | 98 | Main component as a main component | in stock |
| P-889907142 | AA Blocks | AA Blocks - synthesis | N/A | Main component as a main component | by synthesis |
| P-890159822 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-889912529 | AA Blocks | AA Blocks - synthesis | N/A | Main component as a main component | by synthesis |
| P-875749194 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-875749247 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-875765749 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-881661917 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-881662317 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-590416339 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-590416340 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-874606420 | AK Scientific | Building Blocks | 96 | Main component as a main component | in stock |
| P-869330143 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-881616787 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-606874652 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-489224889 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component as a main component | in stock |
| P-489240551 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component as a main component | in stock |
| P-489171695 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component as a main component | in stock |
| P-868830976 | Angene | Building Blocks in stock | 96 | Main component as a main component | 10 g |
| P-596984903 | Angene | Building Blocks in stock | 98 | Main component as a main component | 470 g |
| P-596955768 | Angene | Building Blocks in stock | 98 | Main component as a main component | 279 g |
| P-596989320 | Angene | Building Blocks in stock | 97 | Main component as a main component | 400 g |
| P-865913490 | Angene | Building Blocks in stock | 95 | Main component as a main component | 10 g |
| P-888815276 | Angene | Building Blocks in stock | N/A | Main component as a main component | 45 g |
| P-494331415 | Apollo Scientific | On request | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-889848885 | AstaTech | Backordered BBs | 95 | Main component as a main component | by synthesis |
| P-864183923 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-864198570 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-864208065 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-890229561 | BLD pharm | Non-stock building blocks | 95 | Main component as a main component | by synthesis |
| P-890224021 | BLD pharm | Non-stock building blocks | 95 | Main component as a main component | by synthesis |
| P-674401847 | BLD pharm | In-stock building blocks | 98 | Main component as a main component | 31 g |
| P-580703840 | BLD pharm | In-stock building blocks | 98 | Main component as a main component | 27 g |
| P-872932004 | BLD pharm | In-stock building blocks | 98 | Main component as a main component | 328.7 g |
| P-861476638 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-861477644 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-861479113 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-868602457 | Combi-Blocks | Building Block in stock | 98 | Main component as a main component | in stock |
| P-868604576 | Combi-Blocks | Building Block in stock | 98 | Main component as a main component | in stock |
| P-868613107 | Combi-Blocks | Building Block in stock | 98 | Main component as a main component | in stock |
| P-889297988 | FluoroChem | General BB | 99 | Main component as a main component | in stock |
| P-889434297 | FluoroChem | General BB | N/A | Main component as a main component | in stock |
| P-596565193 | Key Organics | Building Blocks | 97 | Main component as a main component | 5 g |
| P-596564980 | Key Organics | Building Blocks | 97 | Main component as a main component | 5 g |
| P-31249184 | LaboTest | Screening Collection | 90 | Main component as a main component | unavailable |
| P-854794940 | MedChemExpress | Building Blocks on demand | 95 | Main component as a main component | by synthesis |
| P-500402869 | Pi Chemicals | Virtual Compounds | 98 | Main component as a main component | by synthesis |
| P-885537390 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component as a main component | by synthesis |
| P-611446785 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-611446786 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-611446787 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-886897295 | eNovation Chemicals LLC | Building Blocks in stock | 96 | Main component as a main component | in stock |
| P-575292509 | eNovation Chemicals LLC | Building Blocks in stock | 97 | Main component as a main component | in stock |
| P-615413779 | eNovation Chemicals LLC | Building Blocks in stock | 99 | Main component as a main component | in stock |
| P-615452917 | eNovation Chemicals LLC | Building Blocks in stock | 97 | Main component as a main component | in stock |
| P-868520988 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 475.789 |
| logP | 8.1745 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 21 |
| PSA | 40.13 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 151.3154 |
| Atoms | 91 |
| Rings | 1 |
| Heavy atoms | 34 |
| Hydrogen atoms | 57 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
