Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9086862777-0
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 | 7 USD | 95 | 22 working days | Get Quote |
| 5 mg | 7 USD | 95 | 22 working days | Get Quote |
| 10 mg | 7 USD | 95 | 22 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-9086862777-0.sdf |
| SMILES | MCULE-9086862777-0.smiles |
| Standard InChI | MCULE-9086862777-0.inchi |
| InChIKey | MCULE-9086862777-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867627426 | 95 | As is | in stock |
| P-875790057 | N/A | As is | in stock |
| P-590361700 | 98 | As is | in stock |
| P-903142220 | 95 | As is | 2.27 kg |
| P-893511498 | 90 | As is | 2.259 kg |
| P-606906433 | N/A | As is | in stock |
| P-489239313 | 97 | As is | in stock |
| P-596965648 | 95 | As is | 4 g |
| P-596420604 | 90 | As is | 1000 mg |
| P-864192371 | 95 | As is | in stock |
| P-590606658 | 95 | As is | 6.35 g |
| P-492267378 | 95 | As is | in stock |
| P-605409426 | 90 | As is | 1 mg |
| P-619932851 | 90 | As is | by synthesis |
| P-3536487 | 90 | As is | 90 mg |
| P-436455572 | 95 | As is | 10 g |
| P-425233549 | 90 | As is | in stock |
| P-901650911 | 95 | As is | in stock |
| P-580425326 | 95 | As is | by resynthesis (? - ? days) |
| P-1264374724 | 95 | As is | 10 g |
| P-861950199 | 95 | As is | 10 g |
| P-488550057 | 90 | As is | in stock |
| P-12642348 | 95 | As is | 300 mg |
| P-588710884 | 95 | As is | unavailable |
| P-588249104 | N/A | As is | by synthesis |
| P-852382755 | N/A | As is | in stock |
| P-454371928 | 92 | As is | in stock |
| P-23787713 | 92 | As is | 300 mg |
| P-885518218 | 95 | As is | by synthesis |
| P-19099962 | 90 | As is | in stock |
| P-453944309 | 90 | As is | 18 mg |
| P-596764960 | 95 | As is | 12.7 g |
| P-22798042 | 90 | As is | in stock |
| P-873220663 | 90 | As is | in stock |
| P-888355069 | 94 | As is | by resynthesis (? - ? days) |
| P-3215284 | 90 | As is | 5.487 g |
| P-831603 | 90 | As is | 5.487 g |
| P-615407539 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 251.307 |
| logP | 2.3095 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 98.5 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 66.7504 |
| Atoms | 30 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 13 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |
