Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7201864777-0
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 | 6 USD | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 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.
-
MCULE-2826950486-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7201864777-0.sdf |
| SMILES | MCULE-7201864777-0.smiles |
| Standard InChI | MCULE-7201864777-0.inchi |
| InChIKey | MCULE-7201864777-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867539745 | 98 | As is | in stock |
| P-875694689 | N/A | As is | in stock |
| P-588246653 | 98 | As is | in stock |
| P-903017463 | 98 | As is | 2.5 kg |
| P-606940561 | N/A | As is | in stock |
| P-489188775 | 97 | As is | in stock |
| P-596937460 | 98 | As is | 4 kg |
| P-864163643 | 97 | As is | in stock |
| P-580698223 | 98 | As is | 1.18 kg |
| P-619929572 | 90 | As is | by synthesis |
| P-619322640 | 90 | As is | 198 mg |
| P-425212237 | 90 | As is | in stock |
| P-517112938 | 90 | As is | in stock |
| P-868601412 | 98 | As is | in stock |
| P-580420961 | 95 | As is | by resynthesis (? - ? days) |
| P-889115830 | 95 | As is | 100 g |
| P-505492955 | 95 | As is | in stock |
| P-502574087 | 95 | As is | by synthesis |
| P-502945973 | 90 | As is | in stock |
| P-502442872 | 95 | As is | in stock |
| P-488545847 | 90 | As is | in stock |
| P-12722252 | 95 | As is | 210 mg |
| P-856002417 | 90 | As is | 100 mg |
| P-596588431 | 90 | As is | 500 g |
| P-856042540 | 90 | As is | unavailable |
| P-31166305 | 90 | As is | unavailable |
| P-613276439 | 95 | As is | by synthesis |
| P-588252660 | N/A | As is | by synthesis |
| P-852600172 | N/A | As is | in stock |
| P-854740883 | 95 | As is | in stock |
| P-454365926 | 92 | As is | in stock |
| P-500373774 | 98 | As is | by synthesis |
| P-885516202 | 95 | As is | by synthesis |
| P-18924718 | 90 | As is | in stock |
| P-502349497 | 90 | As is | in stock |
| P-33715852 | 94 | As is | by resynthesis (? - ? days) |
| P-906758459 | 98 | As is | by synthesis |
| P-611408851 | 90 | As is | in stock |
| P-3228941 | 90 | As is | 2.004 g |
| P-3242077 | 90 | As is | 2.004 g |
| P-425828 | 90 | As is | 2.004 g |
| P-893994535 | 95 | As is | in stock |
| P-895346973 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 165.232 |
| logP | 2.8531 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 46.25 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 52.1394 |
| Atoms | 27 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 15 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
