Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8598207960
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 | 9 USD | 97 | 20 working days | Get Quote |
| 5 mg | 9 USD | 97 | 20 working days | Get Quote |
| 10 mg | 9 USD | 97 | 20 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.
| Name | File |
|---|---|
| SDF | MCULE-8598207960.sdf |
| SMILES | MCULE-8598207960.smiles |
| Standard InChI | MCULE-8598207960.inchi |
| InChIKey | MCULE-8598207960.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867559761 | 98 | As is | in stock |
| P-875719814 | N/A | As is | in stock |
| P-869186323 | 95 | As is | in stock |
| P-579779227 | 99 | As is | in stock |
| P-903048710 | 97 | As is | 500 g |
| P-851952735 | N/A | As is | in stock |
| P-489198649 | 97 | As is | in stock |
| P-596992115 | 97 | As is | 250 g |
| P-895958347 | 95 | As is | 5 g |
| P-864146851 | 97 | As is | in stock |
| P-619605426 | 98 | As is | 600 g |
| P-893234329 | 95 | As is | in stock |
| P-5840776 | 90 | As is | 232 mg |
| P-425448887 | 90 | As is | in stock |
| P-868602660 | 95 | As is | in stock |
| P-580275221 | 95 | As is | by resynthesis (? - ? days) |
| P-861960217 | 98 | As is | 285.557 g |
| P-18788310 | 95 | As is | 41.51 g |
| P-454376311 | 95 | As is | 41.51 g |
| P-615652887 | 95 | As is | in stock |
| P-901145662 | 98 | As is | unavailable |
| P-31257013 | 90 | As is | unavailable |
| P-852411888 | N/A | As is | in stock |
| P-854744430 | 95 | As is | in stock |
| P-500386914 | 97 | As is | by synthesis |
| P-889881550 | 95 | As is | by synthesis |
| P-12732185 | 90 | As is | 112 mg |
| P-502399255 | 90 | As is | in stock |
| P-23110189 | 94 | As is | by resynthesis (? - ? days) |
| P-906770014 | 98 | As is | by synthesis |
| P-611478891 | 90 | As is | in stock |
| P-868505782 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 205.034 |
| logP | 2.78 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 26.3 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 47.7415 |
| Atoms | 18 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 6 |
| Heteroatoms | 4 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
