MCULE-5295925191
- 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 | 10 USD | 98 | 14 working days | Get Quote |
| 5 mg | 10 USD | 98 | 14 working days | Get Quote |
| 10 mg | 10 USD | 98 | 14 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.
-
MCULE-6483398877
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5295925191.sdf |
| SMILES | MCULE-5295925191.smiles |
| Standard InChI | MCULE-5295925191.inchi |
| InChIKey | MCULE-5295925191.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903018012 | 98 | As is | 4 g |
| P-893457515 | 90 | As is | 4.922 g |
| P-489110284 | 97 | As is | in stock |
| P-500413791 | 95 | As is | by synthesis |
| P-590875367 | 98 | As is | by synthesis |
| P-1263157189 | 95 | As is | by synthesis |
| P-895183421 | 95 | As is | in stock |
| P-878639689 | 98 | As is | in stock |
| P-903018011 | 98 | As a main component | 200 g |
| P-489154898 | 97 | As a main component | in stock |
| P-505575854 | 98 | As a main component | in stock |
| P-868591786 | 98 | As a main component | in stock |
| P-868662853 | 95 | As a main component | in stock |
| P-889436848 | 98 | As a main component | 300 g |
| P-895186866 | 95 | As a main component | in stock |
| P-854711762 | 95 | As a main component | in stock |
| P-584620728 | 95 | As a main component | in stock |
| P-617402362 | N/A | As a main component | in stock |
| P-893111945 | N/A | As an isomer | by synthesis |
| P-872835908 | 95 | As an isomer | in stock |
| P-875846771 | N/A | As an isomer | in stock |
| P-887313554 | 98 | As an isomer | in stock |
| P-903224562 | 98 | As an isomer | 2 g |
| P-893543584 | 90 | As an isomer | 300 mg |
| P-851937122 | N/A | As an isomer | in stock |
| P-489166352 | 97 | As an isomer | in stock |
| P-865928510 | 98 | As an isomer | 5 g |
| P-580192775 | 98 | As an isomer | in stock |
| P-864206116 | 95 | As an isomer | in stock |
| P-619602734 | 98 | As an isomer | 1.45 g |
| P-901479104 | 95 | As an isomer | by synthesis |
| P-901481827 | 95 | As an isomer | by synthesis |
| P-887966348 | 98 | As an isomer | in stock |
| P-580759997 | 90 | As an isomer | by synthesis |
| P-868660828 | 95 | As an isomer | in stock |
| P-590341172 | 90 | As an isomer | 1000 mg |
| P-890218743 | 90 | As an isomer | 1000 mg |
| P-505521128 | 95 | As an isomer | in stock |
| P-890851138 | 90 | As an isomer | in stock |
| P-890850029 | 95 | As an isomer | in stock |
| P-855914986 | 97 | As an isomer | 100 mg |
| P-579617142 | 98 | As an isomer | 100 g |
| P-579616661 | 98 | As an isomer | 2 kg |
| P-896628457 | 95 | As an isomer | by synthesis |
| P-895170661 | 95 | As an isomer | in stock |
| P-896070939 | 95 | As an isomer | in stock |
| P-888171196 | 98 | As an isomer | by synthesis |
| P-881187886 | 90 | As an isomer | 2 g |
| P-859995133 | 95 | As an isomer | by synthesis |
| P-906875935 | 98 | As an isomer | by synthesis |
| P-894007293 | 95 | As an isomer | in stock |
| P-580086985 | 95 | As an isomer | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 388.885 |
| logP | 3.024 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 8 |
| PSA | 53.01 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 113.7258 |
| Atoms | 52 |
| Rings | 3 |
| Heavy atoms | 27 |
| Hydrogen atoms | 25 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |

