MCULE-8792168134
- 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 | 6 USD | 98 | 22 working days | Get Quote | 
| 5 mg | 7 USD | 98 | 22 working days | Get Quote | 
| 10 mg | 8 USD | 98 | 22 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-8820724543
- Component type: Main
 
 - 
                    1
MCULE-6124492894
- Component type: Counter Ion
 
 
| Name | File | 
|---|---|
| SDF | MCULE-8792168134.sdf | 
| SMILES | MCULE-8792168134.smiles | 
| Standard InChI | MCULE-8792168134.inchi | 
| InChIKey | MCULE-8792168134.txt | 
| mcule product ID | Guaranteed purity (%) | Product matching | Availability | 
|---|---|---|---|
| P-505400209 | 95 | As is | in stock | 
| P-889537350 | 95 | As is | in stock | 
| P-861492553 | 95 | As is | by synthesis | 
| P-867609797 | 98 | Main component | in stock | 
| P-875769223 | N/A | Main component | in stock | 
| P-505399663 | 98 | Main component | in stock | 
| P-903108419 | 98 | Main component | 4.45 g | 
| P-893472922 | 90 | Main component | 22.753 g | 
| P-606843763 | N/A | Main component | in stock | 
| P-489122712 | 97 | Main component | in stock | 
| P-596962189 | 98 | Main component | 4.2 g | 
| P-580192467 | 98 | Main component | in stock | 
| P-868543982 | 99 | Main component | in stock | 
| P-580719585 | 99 | Main component | 95 mg | 
| P-871219042 | N/A | Main component | by resynthesis (? - ? days) | 
| P-881634131 | 98 | Main component | in stock | 
| P-851247411 | 95 | Main component | by synthesis | 
| P-860797743 | 98 | Main component | in stock | 
| P-868629370 | 98 | Main component | in stock | 
| P-579478775 | 95 | Main component | in stock | 
| P-505543439 | 95 | Main component | in stock | 
| P-856009402 | 98 | Main component | 245 mg | 
| P-579628970 | 98 | Main component | unavailable | 
| P-852503305 | N/A | Main component | in stock | 
| P-854718972 | 95 | Main component | in stock | 
| P-474028011 | 95 | Main component | in stock | 
| P-608270509 | 98 | Main component | in stock | 
| P-500411374 | 97 | Main component | by synthesis | 
| P-885534596 | 95 | Main component | by synthesis | 
| P-579709947 | N/A | Main component | in stock | 
| P-869161998 | 95 | Main component | by synthesis | 
| P-892296955 | 95 | Main component | unavailable | 
| P-888657393 | 95 | Main component | 101 mg | 
| P-906796485 | 98 | Main component | by synthesis | 
| P-611359975 | 90 | Main component | in stock | 
| P-481014072 | 95 | Main component | in stock | 
| P-856009326 | 95 | Main component as a main component | 100 mg | 
| Property | Value | 
|---|---|
| Components | 2 | 
| Mass | 575.883 | 
| logP | 5.6578 | 
| H-bond acceptors | 9 | 
| H-bond donors | 2 | 
| Rotatable bonds | 9 | 
| PSA | 91.85 | 
| RO5 violations | 2 | 
| RO3 violations | 5 | 
| Refractivity | 154.5384 | 
| Atoms | 64 | 
| Rings | 4 | 
| Heavy atoms | 36 | 
| Hydrogen atoms | 28 | 
| Heteroatoms | 11 | 
| N/O atoms | 9 | 
| Inorganic atoms | 0 | 
| Halogen atoms | 2 | 
| 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 | 

