Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1369603036
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 | 36 USD | 95 | 15 working days | Get Quote |
| 5 mg | 39 USD | N/A | 22 working days | Get Quote |
| 10 mg | 39 USD | N/A | 22 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-6477641482
- Component type: Main
-
1
MCULE-1858636187
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1369603036.sdf |
| SMILES | MCULE-1369603036.smiles |
| Standard InChI | MCULE-1369603036.inchi |
| InChIKey | MCULE-1369603036.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-873214659 | 90 | As is | in stock |
| P-888439234 | 94 | As is | by resynthesis (? - ? days) |
| P-886567580 | 95 | Main component | in stock |
| P-901260048 | N/A | Main component | in stock |
| P-612934896 | 95 | Main component | in stock |
| P-903086623 | 95 | Main component | 5 g |
| P-851451607 | N/A | Main component | by synthesis |
| P-596498722 | 90 | Main component | unavailable |
| P-590775431 | 95 | Main component | by synthesis |
| P-619933255 | 90 | Main component | by synthesis |
| P-851335936 | 95 | Main component | by synthesis |
| P-868554675 | 96 | Main component | in stock |
| P-502511176 | 95 | Main component | by synthesis |
| P-852387527 | N/A | Main component | in stock |
| P-854860859 | 95 | Main component | by synthesis |
| P-19390522 | 90 | Main component | in stock |
| P-611397187 | 90 | Main component | in stock |
| P-893818067 | 95 | Main component | by synthesis |
| P-892860774 | 98 | Main component as a main component | in stock |
| P-901266529 | N/A | Main component as a main component | in stock |
| P-904571696 | 95 | Main component as a main component | in stock |
| P-590408243 | 95 | Main component as a main component | in stock |
| P-494453182 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-892496666 | 90 | Main component as a main component | 1000 mg |
| P-901357874 | 95 | Main component as a main component | by synthesis |
| P-590756542 | 97 | Main component as a main component | by synthesis |
| P-591151011 | 96 | Main component as a main component | by synthesis |
| P-617652451 | 90 | Main component as a main component | in stock |
| P-619849326 | 90 | Main component as a main component | 55 mg |
| P-617325906 | 90 | Main component as a main component | in stock |
| P-1263263771 | 95 | Main component as a main component | by synthesis |
| P-868554701 | 98 | Main component as a main component | in stock |
| P-34603392 | 90 | Main component as a main component | by synthesis |
| P-580758513 | 90 | Main component as a main component | by synthesis |
| P-580783284 | 90 | Main component as a main component | by resynthesis (? - ? days) |
| P-580771261 | 90 | Main component as a main component | in stock |
| P-488552036 | 90 | Main component as a main component | in stock |
| P-24441572 | 95 | Main component as a main component | 300 mg |
| P-855937617 | 97 | Main component as a main component | 10 g |
| P-580473398 | N/A | Main component as a main component | by synthesis |
| P-860790402 | N/A | Main component as a main component | by synthesis |
| P-852395501 | N/A | Main component as a main component | in stock |
| P-852600804 | N/A | Main component as a main component | in stock |
| P-864063826 | 95 | Main component as a main component | by synthesis |
| P-869072983 | 95 | Main component as a main component | by synthesis |
| P-454372712 | 92 | Main component as a main component | in stock |
| P-502440028 | 90 | Main component as a main component | in stock |
| P-611492367 | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 294.705 |
| logP | 3.2007 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 100.7 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 70.1017 |
| Atoms | 35 |
| Rings | 2 |
| Heavy atoms | 19 |
| Hydrogen atoms | 16 |
| Heteroatoms | 8 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
