Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1198803949
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 | 37 USD | 95 | 27 working days | Get Quote |
| 5 mg | 37 USD | 95 | 27 working days | Get Quote |
| 10 mg | 37 USD | 95 | 27 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-1271307984
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1198803949.sdf |
| SMILES | MCULE-1198803949.smiles |
| Standard InChI | MCULE-1198803949.inchi |
| InChIKey | MCULE-1198803949.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-872830106 | 95 | As is | in stock |
| P-875790589 | N/A | As is | in stock |
| P-613853643 | 95 | As is | in stock |
| P-903142069 | 95 | As is | 750 mg |
| P-893510365 | 90 | As is | 10.5 g |
| P-606913154 | N/A | As is | in stock |
| P-489214611 | 97 | As is | in stock |
| P-596932972 | 95 | As is | 500 mg |
| P-864158579 | 95 | As is | in stock |
| P-605419382 | 95 | As is | 350 mg |
| P-861430082 | 95 | As is | by synthesis |
| P-590338317 | 90 | As is | 1000 mg |
| P-890215883 | 90 | As is | 1000 mg |
| P-855964019 | 97 | As is | 1000 mg |
| P-855955669 | 95 | As is | 250 mg |
| P-580468295 | N/A | As is | by synthesis |
| P-852443147 | N/A | As is | in stock |
| P-854801098 | 95 | As is | by synthesis |
| P-19721565 | 90 | As is | in stock |
| P-906865485 | 95 | As is | by synthesis |
| P-611571577 | 90 | As is | in stock |
| P-575300834 | 95 | As is | in stock |
| P-886663902 | 95 | As a main component | in stock |
| P-901288971 | N/A | As a main component | in stock |
| P-869366041 | 95 | As a main component | in stock |
| P-874618873 | 98 | As a main component | in stock |
| P-874621425 | 95 | As a main component | in stock |
| P-903229742 | 95 | As a main component | 1.5 g |
| P-893552001 | 90 | As a main component | 5.574 g |
| P-851886172 | N/A | As a main component | by synthesis |
| P-865928795 | 95 | As a main component | 1.5 g |
| P-895951258 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1263771754 | 95 | As a main component | by synthesis |
| P-591061509 | 95 | As a main component | by synthesis |
| P-901526233 | 95 | As a main component | by synthesis |
| P-617648448 | 90 | As a main component | in stock |
| P-584604924 | 95 | As a main component | 30 g |
| P-617322904 | 90 | As a main component | in stock |
| P-868634001 | 98 | As a main component | in stock |
| P-889310291 | 97 | As a main component | 2.763 g |
| P-862263550 | 95 | As a main component | 1.892 g |
| P-579469670 | 95 | As a main component | 1000 mg |
| P-596600714 | 97 | As a main component | 1000 mg |
| P-563380432 | 95 | As a main component | 250 mg |
| P-613313344 | 95 | As a main component | by synthesis |
| P-855397002 | 95 | As a main component | in stock |
| P-889863617 | 95 | As a main component | by synthesis |
| P-888595984 | 94 | As a main component | by resynthesis (? - ? days) |
| P-611593205 | 90 | As a main component | in stock |
| P-868528829 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 163.259 |
| logP | 3.4328 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 26.02 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 53.3434 |
| Atoms | 29 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 17 |
| Heteroatoms | 1 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
