Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7154530233-0
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 | 99 | 14 working days | Get Quote |
| 5 mg | 6 USD | 99 | 14 working days | Get Quote |
| 10 mg | 6 USD | 99 | 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.
-
1
MCULE-4747891013-2
- Component type: Main
-
1
MCULE-3833394421-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7154530233-0.sdf |
| SMILES | MCULE-7154530233-0.smiles |
| Standard InChI | MCULE-7154530233-0.inchi |
| InChIKey | MCULE-7154530233-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1266047262 | N/A | As is | in stock |
| P-1265771698 | N/A | As is | in stock |
| P-903079517 | 99 | As is | 6 kg |
| P-851712269 | N/A | As is | by synthesis |
| P-596984510 | 99 | As is | 20 kg |
| P-1273461668 | 95 | As is | by resynthesis (? - ? days) |
| P-619596169 | 99 | As is | by synthesis |
| P-893218279 | 95 | As is | in stock |
| P-889424962 | 99 | As is | 20 kg |
| P-855919107 | 97 | As is | 500 g |
| P-885547112 | 95 | As is | by synthesis |
| P-906779498 | 99 | As is | by synthesis |
| P-875725053 | 99 | Main component as a main component | in stock |
| P-903054523 | 99 | Main component as a main component | 5.5 kg |
| P-1270289220 | 95 | Main component as a main component | in stock |
| P-606948485 | N/A | Main component as a main component | in stock |
| P-899936962 | N/A | Main component as a main component | by synthesis |
| P-596947025 | 99 | Main component as a main component | 22 kg |
| P-1274795287 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-666959531 | 95 | Main component as a main component | 9.7 kg |
| P-901888558 | 95 | Main component as a main component | by synthesis |
| P-901462685 | 95 | Main component as a main component | by synthesis |
| P-868609140 | 95 | Main component as a main component | in stock |
| P-889117452 | 95 | Main component as a main component | 600 g |
| P-500417971 | 99 | Main component as a main component | in stock |
| P-855915325 | 97 | Main component as a main component | 25 g |
| P-855918779 | 95 | Main component as a main component | 500 g |
| P-579636992 | 98 | Main component as a main component | by resynthesis (? - ? days) |
| P-31249112 | 90 | Main component as a main component | unavailable |
| P-1272596537 | 95 | Main component as a main component | 5 kg |
| P-852511044 | 95 | Main component as a main component | by synthesis |
| P-1271845394 | 95 | Main component as a main component | in stock |
| P-899991511 | 95 | Main component as a main component | by synthesis |
| P-650819729 | 90 | Main component as a main component | by synthesis |
| P-885560236 | 95 | Main component as a main component | by synthesis |
| P-1274336534 | 95 | Main component as a main component | unavailable |
| P-1274348434 | 95 | Main component as a main component | 99.987 g |
| P-1274358816 | 95 | Main component as a main component | 99.987 g |
| P-906905815 | N/A | Main component as a main component | in stock |
| P-611523208 | 90 | Main component as a main component | in stock |
| P-575297052 | 97 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 188.112 |
| logP | -0.2517 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 77.43 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 38.4183 |
| Atoms | 18 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 5 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 1 |
| 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 |
