Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9744107676
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 | 16 USD | 95 | 14 working days | Get Quote |
| 5 mg | 16 USD | 95 | 14 working days | Get Quote |
| 10 mg | 16 USD | 95 | 14 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-2000360276
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9744107676.sdf |
| SMILES | MCULE-9744107676.smiles |
| Standard InChI | MCULE-9744107676.inchi |
| InChIKey | MCULE-9744107676.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-612893182 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-875759031 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-615722005 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851641338 | AmBeed | On request | N/A | As is | by synthesis |
| P-489201845 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-864155471 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-590991323 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-861342480 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-454410253 | Key Organics | Building Blocks | 95 | As is | 5.575 g |
| P-18803446 | Key Organics | Screening Compounds and Fragments | 95 | As is | 5.575 g |
| P-852414176 | Matrix Scientific | All | N/A | As is | in stock |
| P-854820984 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-502406206 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-855304995 | Toronto Research | In stock | 90 | As is | in stock |
| P-886897231 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-867668223 | A2B Chem | Predominantly Building Block in stock | 98 | As a main component | in stock |
| P-875838648 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-892793741 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-893582544 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As a main component | 28.57 g |
| P-851931735 | AmBeed | In stock | N/A | As a main component | in stock |
| P-865928075 | Angene | Building Blocks in stock | 98 | As a main component | 5.55 g |
| P-494375492 | Apollo Scientific | On request | 95 | As a main component | by resynthesis (? - ? days) |
| P-869390648 | AstaTech | In Stock BBs | 95 | As a main component | in stock |
| P-870587483 | Combi-Blocks | Building Block on demand | 95 | As a main component | by synthesis |
| P-889428254 | FluoroChem | General BB | 98 | As a main component | in stock |
| P-454385284 | Key Organics | Building Blocks | 95 | As a main component | unavailable |
| P-852495702 | Matrix Scientific | All | N/A | As a main component | in stock |
| P-863717815 | MedChemExpress | In stock Building Blocks | 95 | As a main component | in stock |
| P-855322108 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-893989911 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 241.669 |
| logP | 2.214 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 47.56 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 63.7767 |
| Atoms | 28 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 12 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
