Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1698976385
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 | 20 USD | 95 | 20 working days | Get Quote |
| 5 mg | 20 USD | 95 | 20 working days | Get Quote |
| 10 mg | 20 USD | 95 | 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-9099822004
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1698976385.sdf |
| SMILES | MCULE-1698976385.smiles |
| Standard InChI | MCULE-1698976385.inchi |
| InChIKey | MCULE-1698976385.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-488551722 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-24437877 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-454372531 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-867635218 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
| P-875800438 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-613849359 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-851948232 | AmBeed | In stock | N/A | Main component | in stock |
| P-865921002 | Angene | Building Blocks in stock | 95 | Main component | 17.3 g |
| P-869390729 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-851146837 | BLD pharm | In-stock building blocks | 95 | Main component | 17.3 g |
| P-887074941 | Combi-Blocks | Building Block in stock | 98 | Main component | in stock |
| P-580363569 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
| P-889435937 | FluoroChem | General BB | N/A | Main component | in stock |
| P-596596025 | Key Organics | Building Blocks | 90 | Main component | 1000 mg |
| P-852420665 | Matrix Scientific | All | N/A | Main component | in stock |
| P-868743682 | MedChemExpress | In stock Building Blocks | 95 | Main component | in stock |
| P-888873720 | PharmaBlock | In stock | N/A | Main component | in stock |
| P-424877241 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-885530027 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-855231383 | Toronto Research | In stock | 90 | Main component | in stock |
| P-464686691 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | Main component | 215 mg |
| P-2590307 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 215 mg |
| P-868521126 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| P-867669414 | A2B Chem | Predominantly Building Block in stock | 95 | Main component as a main component | in stock |
| P-875843311 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-851504665 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-611041556 | BLD pharm | Non-stock building blocks | 97 | Main component as a main component | by synthesis |
| P-616225909 | ChemBridge | Building Block Library | 95 | Main component as a main component | in stock |
| P-4148163 | ChemBridge | EXPRESS-Pick Collection | 90 | Main component as a main component | 100 mg |
| P-861374612 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-862058285 | FluoroChem | General BB | N/A | Main component as a main component | in stock |
| P-855950456 | Key Organics | Building Blocks | 95 | Main component as a main component | 1000 mg |
| P-854909659 | MedChemExpress | Building Blocks on demand | 95 | Main component as a main component | by synthesis |
| P-868536774 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 240.652 |
| logP | 3.7368 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 29.26 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 57.0204 |
| Atoms | 27 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 12 |
| Heteroatoms | 6 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 4 |
| 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 |
