Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8296518571
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 | 29 USD | 95 | 7 working days | Get Quote |
| 5 mg | 47 USD | 98 | 22 working days | Get Quote |
| 10 mg | 73 USD | 98 | 22 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.
| Name | File |
|---|---|
| SDF | MCULE-8296518571.sdf |
| SMILES | MCULE-8296518571.smiles |
| Standard InChI | MCULE-8296518571.inchi |
| InChIKey | MCULE-8296518571.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867632454 | N/A | As is | in stock |
| P-875796814 | N/A | As is | in stock |
| P-869222331 | 95 | As is | by resynthesis (? - ? days) |
| P-872727766 | 98 | As is | in stock |
| P-1272346993 | 99 | As is | in stock |
| P-893606501 | 90 | As is | 1.355 g |
| P-904029277 | N/A | As is | by synthesis |
| P-895100470 | N/A | As is | 200 mg |
| P-1273260749 | 95 | As is | by resynthesis (? - ? days) |
| P-869420206 | 95 | As is | by synthesis |
| P-868544367 | 99 | As is | in stock |
| P-905556545 | 98 | As is | by synthesis |
| P-887186581 | 95 | As is | by synthesis |
| P-870660722 | N/A | As is | in stock |
| P-873244902 | 97 | As is | 5 mg |
| P-865620896 | 95 | As is | in stock |
| P-1274583801 | 95 | As is | by synthesis |
| P-888173947 | 98 | As is | by synthesis |
| P-892291281 | 95 | As is | unavailable |
| P-869127065 | 95 | As is | 98 mg |
| P-888640261 | 95 | As is | 98 mg |
| P-611372639 | 90 | As is | in stock |
| P-1271616420 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 358.697 |
| logP | 4.847 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 6 |
| PSA | 78.43 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 82.1347 |
| Atoms | 34 |
| Rings | 2 |
| Heavy atoms | 24 |
| Hydrogen atoms | 10 |
| Heteroatoms | 9 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 4 |
| 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 |
