Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3897614152-0
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 | 11 USD | 97 | 20 working days | Get Quote |
| 5 mg | 11 USD | 97 | 20 working days | Get Quote |
| 10 mg | 11 USD | 97 | 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.
| Name | File |
|---|---|
| SDF | MCULE-3897614152-0.sdf |
| SMILES | MCULE-3897614152-0.smiles |
| Standard InChI | MCULE-3897614152-0.inchi |
| InChIKey | MCULE-3897614152-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867605922 | A2B Chem | Predominantly Building Block in stock | N/A | As is | in stock |
| P-875764192 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-612940173 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-436458060 | Alinda | Building Blocks | 95 | As is | in stock |
| P-19983812 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-851637923 | AmBeed | On request | N/A | As is | by synthesis |
| P-489213381 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-873292221 | Angene | Building Blocks in stock | 97 | As is | 10 g |
| P-889792491 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-590892068 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-454670910 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-505593253 | Chemcia | Stock compounds | 97 | As is | in stock |
| P-868581033 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-579802903 | Eximed | In-stock screening compounds | 90 | As is | 6.38 g |
| P-594269373 | Eximed | In-stock screening compounds | 90 | As is | 25.74 g |
| P-889113541 | FluoroChem | In Stock BB | N/A | As is | 2 g |
| P-502788902 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-492222697 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-454383878 | Key Organics | Building Blocks | 95 | As is | 673 mg |
| P-18808873 | Key Organics | Screening Compounds and Fragments | 95 | As is | 673 mg |
| P-852382259 | Matrix Scientific | All | N/A | As is | in stock |
| P-863885585 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-492284203 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1.862 g |
| P-12897148 | Otava | In-House Stock Library | 90 | As is | 6.38 g |
| P-13852875 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-23851569 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-424843554 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885522878 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-873215574 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611385918 | Toronto Research | In stock | 90 | As is | in stock |
| P-611364834 | Toronto Research | In stock | 90 | As is | in stock |
| P-3218966 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.013 g |
| P-1439205 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.013 g |
| P-886900641 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 207.157 |
| logP | 1.3654 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 70.16 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 51.486 |
| Atoms | 21 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 6 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |
