Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6609530201-0
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 | 58 USD | 99 | 19 working days | Get Quote |
| 5 mg | 58 USD | 99 | 19 working days | Get Quote |
| 10 mg | 111 USD | 97 | 27 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.
-
MCULE-2182539591-0
- Component type: Main
-
MCULE-8269026510-0
- Component type: Main
-
MCULE-4305567294-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6609530201-0.sdf |
| SMILES | MCULE-6609530201-0.smiles |
| Standard InChI | MCULE-6609530201-0.inchi |
| InChIKey | MCULE-6609530201-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-893608572 | 90 | As is | 9.375 g |
| P-489196272 | 97 | As is | in stock |
| P-563428531 | 95 | As is | 1000 mg |
| P-524163808 | 99 | As is | 5 mg |
| P-852494751 | 95 | As is | by synthesis |
| P-1275189650 | 99 | As a main component | in stock |
| P-874650269 | 97 | As a main component | by resynthesis (? - ? days) |
| P-489155172 | 97 | As a main component | in stock |
| P-901463487 | 95 | As a main component | by synthesis |
| P-901526982 | 95 | As a main component | by synthesis |
| P-901556963 | 95 | As a main component | by synthesis |
| P-851241016 | 95 | As a main component | by synthesis |
| P-870652419 | N/A | As a main component | in stock |
| P-870652420 | N/A | As a main component | in stock |
| P-505528166 | 95 | As a main component | in stock |
| P-524166065 | 99 | As a main component | 5 mg |
| P-852520072 | 95 | As a main component | by synthesis |
| P-854703296 | 95 | As a main component | by synthesis |
| P-579715483 | N/A | As a main component | in stock |
| P-869151209 | 95 | As a main component | unavailable |
| P-888650800 | 95 | As a main component | unavailable |
| P-906759663 | 98 | As a main component | by synthesis |
| P-611476233 | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 297.416 |
| logP | 5.0218 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 49.5 |
| RO5 violations | 1 |
| RO3 violations | 2 |
| Refractivity | 90.0267 |
| Atoms | 40 |
| Rings | 3 |
| Heavy atoms | 21 |
| Hydrogen atoms | 19 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| 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 |
