Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1808998862
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 | 21 USD | 97 | 20 working days | Get Quote |
| 5 mg | 21 USD | 97 | 20 working days | Get Quote |
| 10 mg | 21 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-5064870708
- Component type: Main
-
1
MCULE-6152801555
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1808998862.sdf |
| SMILES | MCULE-1808998862.smiles |
| Standard InChI | MCULE-1808998862.inchi |
| InChIKey | MCULE-1808998862.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852071090 | A2B Chem | Predominantly Building Block on demand | 97 | As is | by synthesis |
| P-617326368 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-619202129 | Angene | Building Blocks in stock | 97 | As is | 10 g |
| P-896030986 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-861470523 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-580763003 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-596568697 | Key Organics | Building Blocks | 97 | As is | 25 g |
| P-580464031 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-895700903 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-675097287 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-888598003 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-617766721 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 2.65 g |
| P-23116167 | TimTec | ActiMol 2 Week | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 246.155 |
| logP | 2.6626 |
| H-bond acceptors | 0 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 25.3 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 54.51 |
| Atoms | 23 |
| Rings | 0 |
| Heavy atoms | 8 |
| Hydrogen atoms | 15 |
| Heteroatoms | 2 |
| N/O atoms | 0 |
| 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 |
