Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7708465903
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 | 40 USD | 90 | 22 working days | Get Quote |
| 5 mg | 58 USD | 90 | 22 working days | Get Quote |
| 10 mg | 73 USD | 90 | 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-7708465903.sdf |
| SMILES | MCULE-7708465903.smiles |
| Standard InChI | MCULE-7708465903.inchi |
| InChIKey | MCULE-7708465903.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-872830127 | 98 | As is | in stock |
| P-875790657 | N/A | As is | in stock |
| P-869277757 | 98 | As is | in stock |
| P-903142124 | 95 | As is | 1000 mg |
| P-851764778 | N/A | As is | by synthesis |
| P-489171205 | 97 | As is | in stock |
| P-895099635 | 97 | As is | unavailable |
| P-591177304 | 95 | As is | by synthesis |
| P-580423353 | 95 | As is | by resynthesis (? - ? days) |
| P-905315010 | 96 | As is | 5 g |
| P-863615578 | 96 | As is | by synthesis |
| P-505522214 | 95 | As is | in stock |
| P-13988910 | 95 | As is | 221 mg |
| P-588710550 | 95 | As is | unavailable |
| P-580495537 | 97 | As is | by synthesis |
| P-852606970 | N/A | As is | in stock |
| P-35181975 | 95 | As is | 12.326 kg |
| P-854887224 | 95 | As is | by synthesis |
| P-500405912 | 98 | As is | by synthesis |
| P-868129887 | 90 | As is | in stock |
| P-33209003 | 90 | As is | in stock |
| P-873223434 | 90 | As is | in stock |
| P-914139678 | 90 | As is | by synthesis |
| P-914139648 | 90 | As is | unavailable |
| P-914139700 | 90 | As is | unavailable |
| P-594189551 | 90 | As is | 50 mg |
| P-893680726 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 208.304 |
| logP | 3.6792 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 73.55 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 57.8265 |
| Atoms | 21 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 8 |
| Heteroatoms | 3 |
| N/O atoms | 1 |
| 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 |
