Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5682519246
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 | 33 USD | 90 | 23 working days | Get Quote |
| 5 mg | 52 USD | 90 | 19 working days | Get Quote |
| 10 mg | 66 USD | 90 | 19 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-5682519246.sdf |
| SMILES | MCULE-5682519246.smiles |
| Standard InChI | MCULE-5682519246.inchi |
| InChIKey | MCULE-5682519246.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886600148 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-889922126 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-613849763 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-436462225 | Alinda | Building Blocks | 95 | As is | in stock |
| P-851737245 | AmBeed | On request | N/A | As is | by synthesis |
| P-596457285 | Asinex | General screening catalog | 90 | As is | 1000 mg |
| P-596517844 | Asinex | General bb catalog | 90 | As is | 1000 mg |
| P-889833387 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590922924 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-619932716 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-619281884 | ChemDiv | Discovery Chemistry Library | 90 | As is | 7 mg |
| P-887120681 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-428587926 | Eximed | In-stock screening compounds | 90 | As is | 1.97 g |
| P-492272435 | Eximed | Building Block Catalog | 95 | As is | 1.97 g |
| P-861974404 | FluoroChem | General BB | N/A | As is | in stock |
| P-492246203 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502966934 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-502473968 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-488549619 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-13719614 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-596595146 | Key Organics | Building Blocks | 90 | As is | 1000 mg |
| P-852402684 | Matrix Scientific | All | N/A | As is | in stock |
| P-492284583 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 2.97 g |
| P-34052029 | Otava | In-House Stock Library | 90 | As is | 2.97 g |
| P-454371725 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-445303047 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-856065320 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 2.97 g |
| P-19518657 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-502340532 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-855223176 | Toronto Research | In stock | 90 | As is | in stock |
| P-464684066 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1000 mg |
| P-1909703 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1000 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 253.705 |
| logP | 3.0906 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 78.43 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 64.1048 |
| Atoms | 24 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 8 |
| Heteroatoms | 5 |
| 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 |
