MCULE-6284821429-0
- 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 | 49 USD | 90 | 21 working days | Get Quote |
| 5 mg | 67 USD | 95 | 21 working days | Get Quote |
| 10 mg | 67 USD | 95 | 21 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.
-
MCULE-2051107739-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6284821429-0.sdf |
| SMILES | MCULE-6284821429-0.smiles |
| Standard InChI | MCULE-6284821429-0.inchi |
| InChIKey | MCULE-6284821429-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867544451 | 95 | As is | in stock |
| P-875701692 | N/A | As is | in stock |
| P-597017495 | 97 | As is | in stock |
| P-869216536 | 95 | As is | in stock |
| P-875898494 | 95 | As is | by resynthesis (? - ? days) |
| P-864152381 | 95 | As is | in stock |
| P-454676752 | 90 | As is | in stock |
| P-34883965 | 90 | As is | in stock |
| P-868567473 | 98 | As is | in stock |
| P-580277878 | 95 | As is | by resynthesis (? - ? days) |
| P-855931631 | 95 | As is | 1000 mg |
| P-872929717 | N/A | As is | by synthesis |
| P-852529839 | N/A | As is | in stock |
| P-854838630 | 95 | As is | by synthesis |
| P-424433150 | 90 | As is | 333 mg |
| P-492287098 | 95 | As is | 333 mg |
| P-906881721 | 95 | As is | by synthesis |
| P-611533658 | 90 | As is | in stock |
| P-867678737 | N/A | As a main component | in stock |
| P-875855935 | N/A | As a main component | in stock |
| P-904584200 | 95 | As a main component | in stock |
| P-851530113 | N/A | As a main component | by synthesis |
| P-866727428 | 95 | As a main component | 4 g |
| P-616200655 | 95 | As a main component | by synthesis |
| P-861512352 | 95 | As a main component | by synthesis |
| P-869030207 | 95 | As a main component | by synthesis |
| P-873212520 | 90 | As a main component | in stock |
| P-855160868 | 90 | As a main component | in stock |
| P-893791005 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 104.065 |
| logP | -0.0281 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 88.91 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 22.7404 |
| Atoms | 11 |
| Rings | 0 |
| Heavy atoms | 7 |
| Hydrogen atoms | 4 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |

