Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1281660794-0
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 | 20 USD | 97 | 22 working days | Get Quote |
| 5 mg | 20 USD | 97 | 22 working days | Get Quote |
| 10 mg | 20 USD | 97 | 22 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-2103846884-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1281660794-0.sdf |
| SMILES | MCULE-1281660794-0.smiles |
| Standard InChI | MCULE-1281660794-0.inchi |
| InChIKey | MCULE-1281660794-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886595595 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-889919918 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-613848007 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851389746 | AmBeed | On request | N/A | As is | by synthesis |
| P-892496554 | Asinex | General screening catalog | 90 | As is | 1000 mg |
| P-611005379 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-861388654 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-852401971 | Matrix Scientific | All | N/A | As is | in stock |
| P-873215989 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-893768671 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| P-867578645 | A2B Chem | Predominantly Building Block in stock | 97 | Main component | in stock |
| P-875738623 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-869243616 | AK Scientific | Building Blocks | 98 | Main component | in stock |
| P-580205138 | Aldlab Chemicals | Building Block Custom Synth | 95 | Main component | by synthesis |
| P-851785934 | AmBeed | On request | N/A | Main component | by synthesis |
| P-489133087 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component | in stock |
| P-596494546 | Asinex | General bb catalog | 90 | Main component | unavailable |
| P-591141181 | BLD pharm | Non-stock building blocks | 98 | Main component | by synthesis |
| P-619933167 | ChemDiv | Building Blocks on demand | 90 | Main component | by synthesis |
| P-868600475 | Combi-Blocks | Building Block in stock | 98 | Main component | in stock |
| P-861953671 | FluoroChem | General BB | 97 | Main component | in stock |
| P-454403039 | Key Organics | Building Blocks | 95 | Main component | 1.068 g |
| P-454322561 | Key Organics | Screening Compounds and Fragments | 95 | Main component | 1.068 g |
| P-492285412 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | Main component | 1000 mg |
| P-26536171 | Otava | In-House Stock Library | 90 | Main component | 1000 mg |
| P-19585375 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-1416084 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 1.181 g |
| P-575329984 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 209.674 |
| logP | 3.3505 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 54.7 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 60.3591 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 12 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
