MCULE-3296123143
- 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 | 7 USD | 98 | 14 working days | Get Quote |
| 5 mg | 7 USD | 98 | 14 working days | Get Quote |
| 10 mg | 7 USD | 98 | 14 working days | Get Quote |
- 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-9106832696
- Component type: Main
-
3
MCULE-6124492894
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3296123143.sdf |
| SMILES | MCULE-3296123143.smiles |
| Standard InChI | MCULE-3296123143.inchi |
| InChIKey | MCULE-3296123143.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-856026103 | 90 | As is | 2 g |
| P-875804450 | N/A | Main component as a main component | in stock |
| P-590396906 | 98 | Main component as a main component | in stock |
| P-903162180 | 98 | Main component as a main component | 25 g |
| P-1264050971 | 95 | Main component as a main component | in stock |
| P-606913850 | N/A | Main component as a main component | in stock |
| P-596968475 | 98 | Main component as a main component | 25 g |
| P-580194481 | 98 | Main component as a main component | in stock |
| P-864171708 | 98 | Main component as a main component | in stock |
| P-580699071 | 98 | Main component as a main component | 3.992 g |
| P-851278391 | 95 | Main component as a main component | by synthesis |
| P-868617650 | 98 | Main component as a main component | in stock |
| P-870661274 | N/A | Main component as a main component | in stock |
| P-596564056 | 97 | Main component as a main component | 1000 mg |
| P-896628833 | 95 | Main component as a main component | by synthesis |
| P-854716470 | 95 | Main component as a main component | in stock |
| P-474023581 | 95 | Main component as a main component | in stock |
| P-608276451 | 98 | Main component as a main component | in stock |
| P-1263956060 | 90 | Main component as a main component | in stock |
| P-885540740 | 95 | Main component as a main component | by synthesis |
| P-579710975 | N/A | Main component as a main component | in stock |
| P-869108046 | 95 | Main component as a main component | by synthesis |
| P-892286694 | 95 | Main component as a main component | unavailable |
| P-888627085 | 95 | Main component as a main component | 98 mg |
| P-615418468 | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 4 |
| Mass | 750.527 |
| logP | 4.3727 |
| H-bond acceptors | 6 |
| H-bond donors | 0 |
| Rotatable bonds | 21 |
| PSA | 27.69 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 184.1052 |
| Atoms | 99 |
| Rings | 1 |
| Heavy atoms | 39 |
| Hydrogen atoms | 60 |
| Heteroatoms | 9 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |

