Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7249375457-0
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 | 13 USD | 60 | 12 working days | Get Quote |
| 5 mg | 13 USD | 60 | 12 working days | Get Quote |
| 10 mg | 13 USD | 60 | 12 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-3203769500-0
- Component type: Main
-
2
MCULE-1504889908-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7249375457-0.sdf |
| SMILES | MCULE-7249375457-0.smiles |
| Standard InChI | MCULE-7249375457-0.inchi |
| InChIKey | MCULE-7249375457-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-31250025 | 90 | As is | 10 g |
| P-875822766 | 60 | Main component | in stock |
| P-1275178900 | 60 | Main component | in stock |
| P-901464612 | 95 | Main component | by synthesis |
| P-868612996 | 60 | Main component | in stock |
| P-580442621 | 95 | Main component | by resynthesis (? - ? days) |
| P-881680544 | N/A | Main component | by resynthesis (? - ? days) |
| P-870659449 | 60 | Main component | in stock |
| P-596602743 | 95 | Main component | 921 mg |
| P-856039945 | 90 | Main component | unavailable |
| P-31250737 | 90 | Main component | unavailable |
| P-580478491 | 60 | Main component | by synthesis |
| P-852602100 | 60 | Main component | by synthesis |
| P-855053854 | 90 | Main component | in stock |
| P-854986062 | 90 | Main component | in stock |
| P-855050434 | 90 | Main component | in stock |
| P-867591234 | 98 | Main component as a main component | in stock |
| P-867634224 | 98 | Main component as a main component | in stock |
| P-875749668 | 98 | Main component as a main component | in stock |
| P-875798968 | 98 | Main component as a main component | in stock |
| P-1275165070 | 98 | Main component as a main component | in stock |
| P-590377543 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-1264057170 | 98 | Main component as a main component | in stock |
| P-893606325 | 90 | Main component as a main component | 50 g |
| P-1270391368 | 96 | Main component as a main component | in stock |
| P-617058904 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-851933558 | N/A | Main component as a main component | in stock |
| P-1273227003 | N/A | Main component as a main component | in stock |
| P-596985386 | 96 | Main component as a main component | 2 kg |
| P-865911211 | 96 | Main component as a main component | 25 g |
| P-1273266894 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-1273414273 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-864208614 | 95 | Main component as a main component | in stock |
| P-864126551 | 95 | Main component as a main component | in stock |
| P-1273228100 | 96 | Main component as a main component | 300.7 g |
| P-619602123 | 96 | Main component as a main component | 37.5 g |
| P-893248715 | 95 | Main component as a main component | by synthesis |
| P-851326341 | 95 | Main component as a main component | by synthesis |
| P-868575157 | 96 | Main component as a main component | in stock |
| P-868619146 | 98 | Main component as a main component | in stock |
| P-580280389 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-1273138039 | 96 | Main component as a main component | 50 g |
| P-896539290 | 60 | Main component as a main component | 124 g |
| P-524161321 | 98 | Main component as a main component | 5 g |
| P-855961043 | 95 | Main component as a main component | 5 g |
| P-889737592 | N/A | Main component as a main component | in stock |
| P-878644984 | 98 | Main component as a main component | in stock |
| P-885550338 | 95 | Main component as a main component | by synthesis |
| P-889869063 | 95 | Main component as a main component | by synthesis |
| P-617403881 | N/A | Main component as a main component | in stock |
| P-869126490 | 95 | Main component as a main component | 992 mg |
| P-892290962 | 95 | Main component as a main component | 992 mg |
| P-888639862 | 95 | Main component as a main component | 992 mg |
| P-906864431 | 96 | Main component as a main component | by synthesis |
| P-906866009 | 97 | Main component as a main component | by synthesis |
| P-1271709590 | 97 | Main component as a main component | in stock |
| P-615417417 | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 342.397 |
| logP | 1.1214 |
| H-bond acceptors | 12 |
| H-bond donors | 8 |
| Rotatable bonds | 7 |
| PSA | 242.06 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 70.4174 |
| Atoms | 42 |
| Rings | 0 |
| Heavy atoms | 20 |
| Hydrogen atoms | 22 |
| Heteroatoms | 14 |
| N/O atoms | 12 |
| 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 |
