Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3539898271-0
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 | 9 USD | 97 | 20 working days | Get Quote |
| 5 mg | 9 USD | 97 | 20 working days | Get Quote |
| 10 mg | 9 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.
-
1
MCULE-5814360181-0
- Component type: Main
-
1
MCULE-6124492894-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3539898271-0.sdf |
| SMILES | MCULE-3539898271-0.smiles |
| Standard InChI | MCULE-3539898271-0.inchi |
| InChIKey | MCULE-3539898271-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-617652485 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-619826603 | ChemDiv | Discovery Chemistry Library | 90 | As is | 39 mg |
| P-34609576 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-580783879 | Crea-Chim | Building Blocks | 95 | As is | by resynthesis (? - ? days) |
| P-580771547 | Crea-Chim | Prepacked BB compounds with prompt delivery | 95 | As is | in stock |
| P-862087889 | FluoroChem | General BB | N/A | As is | in stock |
| P-502440086 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-867598915 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
| P-875756581 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-590394371 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-866100326 | Advanced Chemical Intermediates (ACI) | ACI predominantly BB catalog | 95 | Main component | unavailable |
| P-851941356 | AmBeed | In stock | N/A | Main component | in stock |
| P-596993193 | Angene | Building Blocks in stock | 97 | Main component | 75.5 g |
| P-494334917 | Apollo Scientific | On request | 95 | Main component | by resynthesis (? - ? days) |
| P-596492641 | Asinex | General bb catalog | 90 | Main component | 172 mg |
| P-596410745 | Asinex | General screening catalog | 90 | Main component | 172 mg |
| P-864103679 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-889746924 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | Main component | 1 mg |
| P-613860448 | BLD pharm | In-stock building blocks | 95 | Main component | 75.5 g |
| P-577180429 | ChemDiv | Building Blocks on demand | 90 | Main component | by synthesis |
| P-505587960 | Chemcia | Stock compounds | 97 | Main component | in stock |
| P-851273018 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-868590434 | Combi-Blocks | Building Block in stock | 98 | Main component | in stock |
| P-580415400 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
| P-861937402 | FluoroChem | General BB | N/A | Main component | in stock |
| P-454380740 | Key Organics | Building Blocks | 95 | Main component | 19.248 g |
| P-18797573 | Key Organics | Screening Compounds and Fragments | 95 | Main component | 19.248 g |
| P-615646492 | LabNetwork | In stock | 95 | Main component | in stock |
| P-580506852 | Manchester Organics | Compounds on demand | N/A | Main component | by synthesis |
| P-852413357 | Matrix Scientific | All | N/A | Main component | in stock |
| P-854732583 | MedChemExpress | In stock Building Blocks | 95 | Main component | in stock |
| P-12629080 | Otava | In-House Stock Library | 90 | Main component | 236 mg |
| P-23902664 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-498714809 | Synthonix | In-stock Building Blocks | 97 | Main component | 7 g |
| P-873216605 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-611456805 | Toronto Research | In stock | 90 | Main component | in stock |
| P-1579987 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 155 mg |
| P-480892184 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| P-26434750 | Otava | In-House Stock Library | 90 | Main component as a main component | 0 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 285.137 |
| logP | 2.7775 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 43.6 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 66.2835 |
| Atoms | 29 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 13 |
| 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 |
