Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1001711150
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 | 10 USD | 99 | 20 working days | Get Quote |
| 5 mg | 10 USD | 99 | 20 working days | Get Quote |
| 10 mg | 10 USD | 99 | 20 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-1376135967
- Component type: Main
-
2
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1001711150.sdf |
| SMILES | MCULE-1001711150.smiles |
| Standard InChI | MCULE-1001711150.inchi |
| InChIKey | MCULE-1001711150.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-869192709 | 95 | As is | in stock |
| P-505354144 | 99 | As is | in stock |
| P-893617871 | 90 | As is | 715.384 g |
| P-596945163 | 99 | As is | 500 g |
| P-580194255 | 98 | As is | in stock |
| P-895938392 | 95 | As is | by resynthesis (? - ? days) |
| P-864163142 | 95 | As is | in stock |
| P-901458025 | 95 | As is | by synthesis |
| P-893219090 | 95 | As is | in stock |
| P-580450277 | 99 | As is | in stock |
| P-500417498 | 99 | As is | in stock |
| P-505516894 | 95 | As is | in stock |
| P-890850994 | 90 | As is | in stock |
| P-524443345 | 97 | As is | 1.054 g |
| P-31194651 | 90 | As is | 500 mg |
| P-881187631 | 90 | As is | 37 mg |
| P-13673030 | 92 | As is | 300 mg |
| P-885543498 | 95 | As is | by synthesis |
| P-579710607 | N/A | As is | in stock |
| P-869108093 | 95 | As is | by synthesis |
| P-892286762 | 95 | As is | 1.199 g |
| P-888627136 | 95 | As is | 1.199 g |
| P-906770297 | 99 | As is | by synthesis |
| P-611377638 | 90 | As is | in stock |
| P-666970853 | 95 | As is | in stock |
| P-872935912 | 95 | Main component | in stock |
| P-867358536 | N/A | Main component | by synthesis |
| P-907347226 | 90 | Main component | 1000 mg |
| P-893584718 | 90 | Main component | 6.523 g |
| P-899928791 | N/A | Main component | by synthesis |
| P-619132422 | 98 | Main component | 1.405 g |
| P-864256995 | 95 | Main component | by synthesis |
| P-864199663 | 95 | Main component | in stock |
| P-901535706 | 95 | Main component | by synthesis |
| P-505493291 | 95 | Main component | in stock |
| P-488556032 | 92 | Main component | in stock |
| P-855913612 | 97 | Main component | 5 g |
| P-500375730 | 98 | Main component | by synthesis |
| P-855009662 | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 477.412 |
| logP | 6.865 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 6 |
| PSA | 6.48 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 139.703 |
| Atoms | 60 |
| Rings | 4 |
| Heavy atoms | 32 |
| Hydrogen atoms | 28 |
| Heteroatoms | 6 |
| N/O atoms | 2 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
