Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8064322897-0
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 | 91 USD | 98 | 20 working days | Get Quote |
| 5 mg | 91 USD | 98 | 20 working days | Get Quote |
| 10 mg | 91 USD | 98 | 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-9669688749-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8064322897-0.sdf |
| SMILES | MCULE-8064322897-0.smiles |
| Standard InChI | MCULE-8064322897-0.inchi |
| InChIKey | MCULE-8064322897-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867670716 | 95 | As is | in stock |
| P-875844277 | N/A | As is | in stock |
| P-894665439 | 95 | As is | in stock |
| P-903215216 | 98 | As is | 3 g |
| P-893496682 | 90 | As is | 9.383 g |
| P-851861783 | N/A | As is | by synthesis |
| P-865928155 | 98 | As is | 2 g |
| P-895953198 | 95 | As is | by resynthesis (? - ? days) |
| P-869389863 | 95 | As is | in stock |
| P-591015542 | 95 | As is | by synthesis |
| P-901487522 | 95 | As is | by synthesis |
| P-492261830 | 95 | As is | in stock |
| P-861387799 | 95 | As is | by synthesis |
| P-862082518 | 95 | As is | 3.033 g |
| P-855951472 | 95 | As is | 5 g |
| P-855400990 | 95 | As is | in stock |
| P-888861360 | N/A | As is | in stock |
| P-611566436 | 90 | As is | in stock |
| P-868517050 | 95 | As is | in stock |
| P-875704414 | N/A | Main component | in stock |
| P-890256992 | 97 | Main component | by synthesis |
| P-869357758 | 95 | Main component | in stock |
| P-907388119 | 90 | Main component | 1000 mg |
| P-606853578 | N/A | Main component | in stock |
| P-489218698 | 97 | Main component | in stock |
| P-864142350 | 95 | Main component | in stock |
| P-905132020 | 95 | Main component | 50 mg |
| P-868629582 | 95 | Main component | in stock |
| P-855986168 | 97 | Main component | 100 mg |
| P-895268286 | 95 | Main component | by synthesis |
| P-893665216 | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 187.622 |
| logP | 1.8191 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 50.19 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 47.7128 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 10 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
