Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2189606400
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 | 125 USD | 97 | 9 working days | Get Quote |
| 5 mg | 125 USD | 97 | 9 working days | Get Quote |
| 10 mg | 125 USD | 97 | 9 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-2877116877
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2189606400.sdf |
| SMILES | MCULE-2189606400.smiles |
| Standard InChI | MCULE-2189606400.inchi |
| InChIKey | MCULE-2189606400.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-612893794 | 95 | As is | by synthesis |
| P-901190531 | 95 | As is | by synthesis |
| P-597013822 | 95 | As is | unavailable |
| P-869229230 | 95 | As is | by resynthesis (? - ? days) |
| P-903115984 | 95 | As is | 291 g |
| P-610984427 | 90 | As is | 631 g |
| P-875896687 | 95 | As is | in stock |
| P-851901040 | N/A | As is | by synthesis |
| P-619187680 | 95 | As is | 291 g |
| P-1274824221 | 95 | As is | by resynthesis (? - ? days) |
| P-864133391 | 95 | As is | in stock |
| P-591147437 | 95 | As is | by synthesis |
| P-1275591266 | 95 | As is | by synthesis |
| P-861282259 | 97 | As is | in stock |
| P-887240745 | 95 | As is | by synthesis |
| P-862101534 | 95 | As is | 291 g |
| P-505548764 | 95 | As is | in stock |
| P-524200920 | 95 | As is | 1000 mg |
| P-579628680 | 95 | As is | in stock |
| P-852522594 | 95 | As is | by synthesis |
| P-864062459 | 95 | As is | by synthesis |
| P-873279526 | N/A | As is | in stock |
| P-611424097 | 90 | As is | in stock |
| P-615460083 | 95 | As is | in stock |
| P-867403547 | 95 | Main component | by synthesis |
| P-901188863 | 95 | Main component | by synthesis |
| P-853428238 | 95 | Main component | by resynthesis (? - ? days) |
| P-903101110 | 95 | Main component | 191 g |
| P-893510669 | 90 | Main component | 431.5 g |
| P-1275132601 | 95 | Main component | in stock |
| P-851893544 | N/A | Main component | by synthesis |
| P-489213065 | 97 | Main component | in stock |
| P-888816166 | 95 | Main component | 191 g |
| P-1274807330 | 95 | Main component | by resynthesis (? - ? days) |
| P-889455252 | 95 | Main component | by synthesis |
| P-591134910 | 98 | Main component | by synthesis |
| P-1275591265 | 95 | Main component | by synthesis |
| P-861282085 | 97 | Main component | in stock |
| P-905264219 | 97 | Main component | in stock |
| P-889309502 | 95 | Main component | 191 g |
| P-500158170 | 96 | Main component | in stock |
| P-579624560 | 95 | Main component | in stock |
| P-884896563 | N/A | Main component | by synthesis |
| P-854820991 | 95 | Main component | by synthesis |
| P-611424096 | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 253.766 |
| logP | 3.37 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 20.31 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 76.957 |
| Atoms | 37 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 20 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| 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 |
