Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4823211881-0
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 | 6 USD | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 USD | 98 | 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-4823211881-0.sdf |
| SMILES | MCULE-4823211881-0.smiles |
| Standard InChI | MCULE-4823211881-0.inchi |
| InChIKey | MCULE-4823211881-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867576670 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875737309 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869195041 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-575539276 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-903066676 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As is | 300 g |
| P-893564190 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 1.00039 kg |
| P-875896083 | Allbio Pharm | In stock | N/A | As is | in stock |
| P-606896334 | AmBeed | In stock | N/A | As is | in stock |
| P-596951471 | Angene | Building Blocks in stock | 98 | As is | 200 g |
| P-895929717 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864155843 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-580726150 | BLD pharm | In-stock building blocks | 98 | As is | 11 g |
| P-893231801 | Biosynth | In Stock | 95 | As is | in stock |
| P-619928060 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-448676621 | ChemDiv | Discovery Chemistry Library | 90 | As is | 190 mg |
| P-436460370 | Chemical Intelligence Co Limited | Building Blocks | 95 | As is | 50 g |
| P-425203492 | Chemical Intelligence Co Limited | Stock Screening Compounds | 90 | As is | in stock |
| P-868603761 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580270723 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-901376047 | FluoroChem | In Stock BB | N/A | As is | 10 g |
| P-505541056 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-596570775 | Key Organics | Building Blocks | 97 | As is | 5 g |
| P-856006760 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-31201205 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-588249534 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852431899 | Matrix Scientific | All | N/A | As is | in stock |
| P-854739754 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-901176980 | Otava | In-House Stock Library | 90 | As is | 50 mg |
| P-888885152 | PharmaBlock | In stock | N/A | As is | in stock |
| P-500386265 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-885527510 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-18939829 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-896074075 | Specs | Repurposed Compounds | N/A | As is | 66 mg |
| P-904097978 | Synthonix | In-stock Building Blocks | 97 | As is | 282 g |
| P-22729849 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502397823 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-903657756 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-611481692 | Toronto Research | In stock | 90 | As is | in stock |
| P-3244643 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 1.95 g |
| P-486842 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.95 g |
| P-464678635 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.95 g |
| P-893947233 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 197.144 |
| logP | 1.6447 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 92.35 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 49.1665 |
| Atoms | 21 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 7 |
| 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 |
