Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5568773777
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 | 26 USD | 98 | 22 working days | Get Quote |
| 5 mg | 26 USD | 98 | 22 working days | Get Quote |
| 10 mg | 26 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-5568773777.sdf |
| SMILES | MCULE-5568773777.smiles |
| Standard InChI | MCULE-5568773777.inchi |
| InChIKey | MCULE-5568773777.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867622298 | 98 | As is | in stock |
| P-875785179 | 98 | As is | in stock |
| P-590363843 | 95 | As is | by resynthesis (? - ? days) |
| P-903133175 | 95 | As is | 20 g |
| P-893546181 | 90 | As is | 12.4 g |
| P-1270302419 | 98 | As is | in stock |
| P-608473467 | 95 | As is | by synthesis |
| P-893299581 | 95 | As is | in stock |
| P-606852698 | N/A | As is | in stock |
| P-489223605 | 97 | As is | in stock |
| P-596964743 | 95 | As is | 5 g |
| P-579782951 | 95 | As is | by resynthesis (? - ? days) |
| P-864142232 | 97 | As is | in stock |
| P-590622449 | 98 | As is | 1000 mg |
| P-505595556 | 97 | As is | in stock |
| P-851309138 | 95 | As is | by synthesis |
| P-868641861 | 98 | As is | in stock |
| P-862082645 | 98 | As is | 4.857 g |
| P-563569662 | 97 | As is | 250 mg |
| P-860789576 | N/A | As is | by synthesis |
| P-1272582866 | 97 | As is | 10 g |
| P-852450280 | 97 | As is | by synthesis |
| P-854749039 | 95 | As is | in stock |
| P-888891146 | N/A | As is | in stock |
| P-885548963 | 95 | As is | by synthesis |
| P-904080952 | 97 | As is | 28.7 g |
| P-873227336 | 90 | As is | in stock |
| P-611368506 | 90 | As is | in stock |
| P-615650794 | 95 | As is | unavailable |
| P-893988337 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 139.127 |
| logP | 1.8016 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 43.09 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 36.1919 |
| Atoms | 16 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 6 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
