Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3092441825-0
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 | 9 USD | 97 | 20 working days | Get Quote |
| 5 mg | 9 USD | 97 | 20 working days | Get Quote |
| 10 mg | 9 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-6659317467-0
- Component type: Main
-
1
MCULE-5133077095-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3092441825-0.sdf |
| SMILES | MCULE-3092441825-0.smiles |
| Standard InChI | MCULE-3092441825-0.inchi |
| InChIKey | MCULE-3092441825-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867540047 | 97 | As is | in stock |
| P-875696145 | N/A | As is | in stock |
| P-903019066 | 97 | As is | 10 g |
| P-905502378 | 95 | As is | by synthesis |
| P-893552868 | 90 | As is | 347.31 g |
| P-606875246 | N/A | As is | in stock |
| P-596926167 | 97 | As is | 75 g |
| P-579792124 | 95 | As is | by resynthesis (? - ? days) |
| P-864109773 | 95 | As is | in stock |
| P-580700737 | 97 | As is | 91.25 g |
| P-868604297 | 97 | As is | in stock |
| P-905328787 | 98 | As is | 2 g |
| P-524185335 | 97 | As is | 25 g |
| P-615655697 | 95 | As is | in stock |
| P-579620042 | 95 | As is | 50 g |
| P-580511300 | 96 | As is | 22 g |
| P-852463158 | N/A | As is | in stock |
| P-863685643 | 95 | As is | in stock |
| P-885545643 | 95 | As is | by synthesis |
| P-596791649 | 97 | As is | 172.5 g |
| P-854657188 | 95 | As is | in stock |
| P-875697865 | N/A | Main component as a main component | in stock |
| P-505347136 | 97 | Main component as a main component | in stock |
| P-903021348 | 98 | Main component as a main component | 50 g |
| P-893574400 | 90 | Main component as a main component | 112.406 g |
| P-893301547 | N/A | Main component as a main component | in stock |
| P-606881252 | N/A | Main component as a main component | in stock |
| P-489199447 | 97 | Main component as a main component | in stock |
| P-596981662 | 97 | Main component as a main component | 45 g |
| P-579792123 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-864166004 | 95 | Main component as a main component | in stock |
| P-605419180 | 95 | Main component as a main component | 7.35 g |
| P-851315872 | 95 | Main component as a main component | by synthesis |
| P-868626658 | 98 | Main component as a main component | in stock |
| P-905344401 | 95 | Main component as a main component | 2.25 g |
| P-862023920 | 95 | Main component as a main component | 79.322 g |
| P-454395313 | 95 | Main component as a main component | 5 g |
| P-860795068 | N/A | Main component as a main component | by synthesis |
| P-852463866 | N/A | Main component as a main component | in stock |
| P-900996262 | 95 | Main component as a main component | in stock |
| P-888883505 | N/A | Main component as a main component | in stock |
| P-500384494 | 97 | Main component as a main component | by synthesis |
| P-885552236 | 95 | Main component as a main component | by synthesis |
| P-611383771 | 90 | Main component as a main component | in stock |
| P-893935976 | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 402.336 |
| logP | 5.3553 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 90.88 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 77.6264 |
| Atoms | 33 |
| Rings | 3 |
| Heavy atoms | 25 |
| Hydrogen atoms | 8 |
| Heteroatoms | 11 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 6 |
| 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 |
