Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5466501744
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 | 35 USD | 95 | 14 working days | Get Quote |
| 10 mg | 41 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.
| Name | File |
|---|---|
| SDF | MCULE-5466501744.sdf |
| SMILES | MCULE-5466501744.smiles |
| Standard InChI | MCULE-5466501744.inchi |
| InChIKey | MCULE-5466501744.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852103176 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-889931173 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-612938560 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-436462059 | Alinda | Building Blocks | 95 | As is | 1000 mg |
| P-19852265 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-851527672 | AmBeed | On request | N/A | As is | by synthesis |
| P-489139922 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596443448 | Asinex | General screening catalog | 90 | As is | 32 mg |
| P-596496066 | Asinex | General bb catalog | 90 | As is | 32 mg |
| P-901358774 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590791174 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-619932823 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-449240319 | ChemDiv | Discovery Chemistry Library | 90 | As is | 5 mg |
| P-861537169 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-580407134 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-579799429 | Eximed | In-stock screening compounds | 90 | As is | 3.19 g |
| P-580088842 | Eximed | Building Block Catalog | 95 | As is | 3.19 g |
| P-502971886 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-492245807 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-488551642 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-617977941 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-596594959 | Key Organics | Building Blocks | 90 | As is | 1000 mg |
| P-613333519 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-852392650 | Matrix Scientific | All | N/A | As is | in stock |
| P-854857528 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-492286141 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 4.69 g |
| P-34053877 | Otava | In-House Stock Library | 90 | As is | 4.69 g |
| P-454372466 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-674529773 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-500398948 | Pi Chemicals | Virtual Compounds | 97 | As is | by synthesis |
| P-856065754 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 4.69 g |
| P-424807711 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-498639735 | SV CHEMBIOTECH | SV Chembiotech Products | 95 | As is | by synthesis |
| P-12918037 | Specs | Screening Compounds | 90 | As is | 39 mg |
| P-502385208 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-872976753 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 10 mg |
| P-855248563 | Toronto Research | In stock | 90 | As is | in stock |
| P-464683801 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.182 g |
| P-681319 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.182 g |
| P-3239035 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 1.182 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 200.192 |
| logP | -0.9237 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 86.71 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 54.1555 |
| Atoms | 26 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 12 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
