MCULE-9046492091
- 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 | 16 USD | 99 | 15 working days | Get Quote | 
| 5 mg | 20 USD | 98 | 16 working days | Get Quote | 
| 10 mg | 26 USD | 98 | 20 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-4299844914
- Component type: Main
 
 - 
                    2
MCULE-7728164114
- Component type: Counter Ion
 
 
| Name | File | 
|---|---|
| SDF | MCULE-9046492091.sdf | 
| SMILES | MCULE-9046492091.smiles | 
| Standard InChI | MCULE-9046492091.inchi | 
| InChIKey | MCULE-9046492091.txt | 
| mcule product ID | Guaranteed purity (%) | Product matching | Availability | 
|---|---|---|---|
| P-875719806 | N/A | As is | in stock | 
| P-597016315 | 98 | As is | in stock | 
| P-595215696 | 98 | As is | in stock | 
| P-903048698 | 98 | As is | 2 g | 
| P-893509334 | 90 | As is | 26.591 g | 
| P-606879591 | N/A | As is | in stock | 
| P-596944872 | 98 | As is | 2 g | 
| P-872722628 | 98 | As is | in stock | 
| P-864113725 | 95 | As is | in stock | 
| P-868543903 | 99 | As is | in stock | 
| P-580697947 | 99 | As is | 1.509 g | 
| P-901454090 | 95 | As is | by synthesis | 
| P-851250102 | 95 | As is | by synthesis | 
| P-860797959 | 98 | As is | in stock | 
| P-861488047 | 95 | As is | by synthesis | 
| P-579478560 | 95 | As is | in stock | 
| P-905326712 | 98 | As is | 100 mg | 
| P-870652267 | N/A | As is | in stock | 
| P-505520479 | 95 | As is | in stock | 
| P-596584005 | 97 | As is | 250 mg | 
| P-579618750 | 98 | As is | unavailable | 
| P-852523347 | N/A | As is | in stock | 
| P-904640897 | 95 | As is | by synthesis | 
| P-854713268 | 95 | As is | in stock | 
| P-584616570 | 95 | As is | in stock | 
| P-608274663 | 98 | As is | in stock | 
| P-885560501 | 95 | As is | by synthesis | 
| P-869132416 | 95 | As is | by synthesis | 
| P-892292066 | 95 | As is | unavailable | 
| P-888643102 | 95 | As is | 51 mg | 
| P-886924217 | 95 | As is | by synthesis | 
| P-867623535 | 98 | Main component | in stock | 
| P-875785872 | N/A | Main component | in stock | 
| P-505400038 | 99 | Main component | in stock | 
| P-903135235 | 98 | Main component | 2 g | 
| P-610995108 | 90 | Main component | 20.51 g | 
| P-606848269 | N/A | Main component | in stock | 
| P-489107664 | 97 | Main component | in stock | 
| P-596964874 | 98 | Main component | 750 mg | 
| P-580192514 | 98 | Main component | in stock | 
| P-864150077 | 95 | Main component | in stock | 
| P-500414655 | 95 | Main component | by synthesis | 
| P-584628344 | 99 | Main component | 1.75 g | 
| P-452661261 | 98 | Main component | in stock | 
| P-851239664 | 95 | Main component | by synthesis | 
| P-860797730 | 98 | Main component | in stock | 
| P-861347026 | 95 | Main component | by synthesis | 
| P-596562167 | 97 | Main component | 100 mg | 
| P-613363014 | 95 | Main component | 5 g | 
| P-852519339 | N/A | Main component | in stock | 
| P-904640898 | 95 | Main component | by synthesis | 
| P-854716493 | 95 | Main component | in stock | 
| P-584616569 | 95 | Main component | in stock | 
| P-878641397 | 98 | Main component | in stock | 
| P-885549967 | 95 | Main component | by synthesis | 
| P-579709798 | N/A | Main component | in stock | 
| P-869161913 | 95 | Main component | by synthesis | 
| P-892296820 | 95 | Main component | unavailable | 
| P-888657300 | 95 | Main component | 100 mg | 
| P-575295677 | 95 | Main component | in stock | 
| Property | Value | 
|---|---|
| Components | 3 | 
| Mass | 558.855 | 
| logP | 6.0794 | 
| H-bond acceptors | 8 | 
| H-bond donors | 2 | 
| Rotatable bonds | 10 | 
| PSA | 88.61 | 
| RO5 violations | 2 | 
| RO3 violations | 5 | 
| Refractivity | 147.7414 | 
| Atoms | 63 | 
| Rings | 4 | 
| Heavy atoms | 36 | 
| Hydrogen atoms | 27 | 
| Heteroatoms | 12 | 
| N/O atoms | 8 | 
| Inorganic atoms | 0 | 
| Halogen atoms | 4 | 
| 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 | 

