Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7796912970
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 | 20 USD | 90 | 21 working days | Get Quote |
| 5 mg | 57 USD | 90 | 22 working days | Get Quote |
| 10 mg | 58 USD | 90 | 21 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-9906163514
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7796912970.sdf |
| SMILES | MCULE-7796912970.smiles |
| Standard InChI | MCULE-7796912970.inchi |
| InChIKey | MCULE-7796912970.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867669811 | 95 | As is | in stock |
| P-875843673 | N/A | As is | in stock |
| P-904562936 | 95 | As is | in stock |
| P-851648240 | N/A | As is | by synthesis |
| P-611103087 | 95 | As is | by synthesis |
| P-616226414 | 95 | As is | in stock |
| P-4155033 | 90 | As is | 100 mg |
| P-861376948 | 95 | As is | by synthesis |
| P-855950855 | 95 | As is | 1000 mg |
| P-864064560 | 95 | As is | by synthesis |
| P-611433192 | 90 | As is | in stock |
| P-893679035 | 95 | As is | by synthesis |
| P-867599822 | 98 | Main component | in stock |
| P-875757513 | N/A | Main component | in stock |
| P-588248568 | 98 | Main component | in stock |
| P-903092428 | 95 | Main component | 5 g |
| P-851537088 | N/A | Main component | by synthesis |
| P-494444358 | 95 | Main component | by resynthesis (? - ? days) |
| P-889810834 | 95 | Main component | by synthesis |
| P-590896347 | 95 | Main component | by synthesis |
| P-504713097 | 85 | Main component | 5 mg |
| P-454756313 | 90 | Main component | in stock |
| P-454701995 | 90 | Main component | in stock |
| P-607694960 | 90 | Main component | 28 mg |
| P-436450953 | 95 | Main component | 4 g |
| P-34458867 | 90 | Main component | by synthesis |
| P-580776033 | 90 | Main component | by resynthesis (? - ? days) |
| P-580765455 | 90 | Main component | in stock |
| P-580382905 | N/A | Main component | by resynthesis (? - ? days) |
| P-579523639 | 90 | Main component | 4.2 g |
| P-890212436 | 90 | Main component | 4.2 g |
| P-502552887 | 95 | Main component | by synthesis |
| P-503002334 | 90 | Main component | in stock |
| P-492238812 | 95 | Main component | in stock |
| P-454296359 | 90 | Main component | 115 mg |
| P-580470334 | N/A | Main component | by synthesis |
| P-852405449 | N/A | Main component | in stock |
| P-35194802 | 90 | Main component | 3.249 kg |
| P-854860042 | 95 | Main component | by synthesis |
| P-491128625 | 95 | Main component | by synthesis |
| P-23858634 | 90 | Main component | in stock |
| P-498640261 | 95 | Main component | by synthesis |
| P-33465549 | 90 | Main component | in stock |
| P-502342282 | 90 | Main component | in stock |
| P-611433191 | 90 | Main component | in stock |
| P-25015324 | 90 | Main component | 778 mg |
| P-893664979 | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 190.630 |
| logP | 1.2252 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 72.94 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 46.3166 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 11 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |
