Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1242547811-0
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 | 35 USD | 95 | 14 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-1242547811-0.sdf |
| SMILES | MCULE-1242547811-0.smiles |
| Standard InChI | MCULE-1242547811-0.inchi |
| InChIKey | MCULE-1242547811-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852101306 | A2B Chem | Predominantly Building Block on demand | 97 | As is | by synthesis |
| P-889929084 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-894650642 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893543100 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 141.83 g |
| P-436475416 | Alinda | Building Blocks | 95 | As is | 4 g |
| P-851910556 | AmBeed | On request | N/A | As is | by synthesis |
| P-489141768 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-873295312 | Angene | Building Blocks in stock | 97 | As is | 2 g |
| P-596492096 | Asinex | General bb catalog | 90 | As is | 16 mg |
| P-596403036 | Asinex | General screening catalog | 90 | As is | 16 mg |
| P-889510492 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-591168744 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-454640402 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-3302808 | ChemDiv | Discovery Chemistry Library | 90 | As is | 116 mg |
| P-872779810 | Chemshuttle | Stock catalog | 95 | As is | 39.08 g |
| P-861538354 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-861949205 | FluoroChem | General BB | N/A | As is | in stock |
| P-855978611 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-852534794 | Matrix Scientific | All | N/A | As is | in stock |
| P-854870212 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-19532382 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-22813546 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-888354424 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-611599894 | Toronto Research | In stock | 90 | As is | in stock |
| P-886897257 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 210.231 |
| logP | 3.6582 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 52.05 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 63.8494 |
| Atoms | 26 |
| Rings | 3 |
| Heavy atoms | 16 |
| Hydrogen atoms | 10 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
