Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2104684798
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 | 16 USD | 98 | 16 working days | Get Quote |
| 5 mg | 16 USD | 98 | 16 working days | Get Quote |
| 10 mg | 16 USD | 98 | 16 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.
-
MCULE-7469837733
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-2104684798.sdf |
| SMILES | MCULE-2104684798.smiles |
| Standard InChI | MCULE-2104684798.inchi |
| InChIKey | MCULE-2104684798.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867579192 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875738726 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-597013856 | AEchem | Building blocks | 95 | As is | in stock |
| P-590403413 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-505390287 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-866099639 | Advanced Chemical Intermediates (ACI) | ACI predominantly BB catalog | 95 | As is | unavailable |
| P-19987542 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-436445822 | Alinda | Building Blocks | 95 | As is | in stock |
| P-851936557 | AmBeed | In stock | N/A | As is | in stock |
| P-489145484 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596983606 | Angene | Building Blocks in stock | 98 | As is | 500 g |
| P-494326936 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-869777934 | Asinex | General screening catalog | 90 | As is | 1000 mg |
| P-864111440 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-666961162 | BLD pharm | In-stock building blocks | 98 | As is | 31 g |
| P-492247438 | ChemBridge | Building Block Library | 95 | As is | in stock |
| P-6250495 | ChemBridge | EXPRESS-Pick Collection | 85 | As is | 25 mg |
| P-454691108 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-874498386 | ChemDiv | Discovery Chemistry Library | 90 | As is | 47 mg |
| P-851269696 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868604209 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-34742195 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-580427465 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-861930964 | FluoroChem | General BB | N/A | As is | in stock |
| P-863615799 | Georganics Ltd. | On request | 97 | As is | by synthesis |
| P-492215647 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502663327 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-502451573 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-503141948 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-488546007 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-12978638 | InterBioScreen | Screening Compounds | 92 | As is | 247 mg |
| P-454343452 | Key Organics | Screening Compounds and Fragments | 90 | As is | unavailable |
| P-615655889 | LabNetwork | In stock | 95 | As is | in stock |
| P-579626042 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-31131420 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-580464757 | Manchester Organics | Compounds on demand | 97 | As is | by synthesis |
| P-852383585 | Matrix Scientific | All | N/A | As is | in stock |
| P-579723376 | Menai Organics | Building blocks | 90 | As is | in stock |
| P-888164017 | Menai Organics | Screening compounds | 90 | As is | in stock |
| P-12974004 | Otava | In-House Stock Library | 90 | As is | 50 mg |
| P-888861541 | PharmaBlock | In stock | N/A | As is | in stock |
| P-454366022 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-13619974 | Pharmeks LLC | Synthetic compounds | 92 | As is | in stock |
| P-500393778 | Pi Chemicals | Virtual Compounds | 97 | As is | by synthesis |
| P-18843622 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885524885 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502331268 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22532618 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 45 mg |
| P-611382222 | Toronto Research | In stock | 90 | As is | in stock |
| P-523777 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.279 g |
| P-3231664 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.279 g |
| P-3241456 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 1.279 g |
| P-615452087 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 212.653 |
| logP | 3.2529 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 65.54 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 53.7943 |
| Atoms | 18 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 5 |
| Heteroatoms | 4 |
| N/O atoms | 2 |
| 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 |
