Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2793158902-0
Structure
Show compound
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 | 2 USD | 98 | 14 working days | Get Quote |
| 5 mg | 2 USD | 98 | 14 working days | Get Quote |
| 10 mg | 2 USD | 98 | 14 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-1868494404-0
- Component type: Main
-
4
MCULE-5646000632-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2793158902-0.sdf |
| SMILES | MCULE-2793158902-0.smiles |
| Standard InChI | MCULE-2793158902-0.inchi |
| InChIKey | MCULE-2793158902-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-620068108 | 90 | As is | 1000 mg |
| P-620223222 | 95 | As is | 1000 mg |
| P-867587058 | 98 | Main component | in stock |
| P-875745659 | N/A | Main component | in stock |
| P-505351404 | 99 | Main component | in stock |
| P-881674405 | N/A | Main component | in stock |
| P-903076512 | 98 | Main component | 294.5 kg |
| P-851945678 | N/A | Main component | in stock |
| P-489138295 | 97 | Main component | in stock |
| P-596954642 | 98 | Main component | 2 kg |
| P-872726243 | 98 | Main component | in stock |
| P-494305628 | 95 | Main component | unavailable |
| P-494305396 | 95 | Main component | unavailable |
| P-1263295351 | 95 | Main component | 625 g |
| P-580698614 | 98 | Main component | 11.475 kg |
| P-901508590 | 95 | Main component | by synthesis |
| P-893228951 | 95 | Main component | in stock |
| P-905358928 | 98 | Main component | 2.225 kg |
| P-500417431 | 99 | Main component | in stock |
| P-608220298 | 98 | Main component | in stock |
| P-505491723 | 95 | Main component | in stock |
| P-502528406 | 95 | Main component | by synthesis |
| P-856008930 | 95 | Main component | 100 mg |
| P-596602790 | 95 | Main component | 100 g |
| P-31186059 | 90 | Main component | unavailable |
| P-885398937 | 98 | Main component | by synthesis |
| P-852466403 | N/A | Main component | in stock |
| P-899992066 | 95 | Main component | by synthesis |
| P-584618307 | 95 | Main component | in stock |
| P-878642959 | 98 | Main component | in stock |
| P-885550379 | 95 | Main component | by synthesis |
| P-19546316 | 90 | Main component | in stock |
| P-869125508 | 95 | Main component | by synthesis |
| P-892290715 | 95 | Main component | 1000 mg |
| P-888639081 | 95 | Main component | 1000 mg |
| P-502332947 | 90 | Main component | in stock |
| P-22510388 | 90 | Main component | 1000 mg |
| P-611511520 | 90 | Main component | in stock |
| P-611351035 | 90 | Main component | in stock |
| P-855053837 | 90 | Main component | in stock |
| P-855008825 | 90 | Main component | in stock |
| P-854980443 | 90 | Main component | in stock |
| P-1027749 | 90 | Main component | 2.886 g |
| P-580086182 | 95 | Main component | in stock |
| P-870653921 | N/A | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 5 |
| Mass | 360.366 |
| logP | -0.7756 |
| H-bond acceptors | 14 |
| H-bond donors | 8 |
| Rotatable bonds | 11 |
| PSA | 168.64 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 81.9716 |
| Atoms | 52 |
| Rings | 0 |
| Heavy atoms | 24 |
| Hydrogen atoms | 28 |
| Heteroatoms | 14 |
| N/O atoms | 14 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
