Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7769730698
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 | 10 USD | 95 | 8 working days | Get Quote |
| 5 mg | 10 USD | 95 | 8 working days | Get Quote |
| 10 mg | 10 USD | 95 | 8 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-7769730698.sdf |
| SMILES | MCULE-7769730698.smiles |
| Standard InChI | MCULE-7769730698.inchi |
| InChIKey | MCULE-7769730698.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867563722 | 95 | As is | in stock |
| P-875723098 | 95 | As is | in stock |
| P-1275194380 | 98 | As is | in stock |
| P-903052287 | 95 | As is | 10 g |
| P-1264059627 | 98 | As is | in stock |
| P-1270378205 | 95 | As is | in stock |
| P-851929117 | N/A | As is | in stock |
| P-489195065 | 97 | As is | in stock |
| P-596987455 | 95 | As is | 5 g |
| P-494344938 | 95 | As is | 8.1 g |
| P-864168333 | 95 | As is | in stock |
| P-1275015269 | 95 | As is | 11.25 g |
| P-666959706 | 95 | As is | 132 g |
| P-893225632 | 95 | As is | in stock |
| P-868644548 | 98 | As is | in stock |
| P-580276459 | 95 | As is | by resynthesis (? - ? days) |
| P-905318044 | 95 | As is | 13.7 g |
| P-870655808 | N/A | As is | in stock |
| P-505494817 | 95 | As is | in stock |
| P-454391830 | 97 | As is | 46.988 g |
| P-454298735 | 97 | As is | 1.628 g |
| P-579661784 | 95 | As is | by resynthesis (? - ? days) |
| P-860790824 | N/A | As is | by synthesis |
| P-901840370 | 95 | As is | in stock |
| P-500402744 | 98 | As is | by synthesis |
| P-502371676 | 90 | As is | in stock |
| P-906863724 | 95 | As is | by synthesis |
| P-611369998 | 90 | As is | in stock |
| P-893996005 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 186.590 |
| logP | 1.6727 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 57.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 45.0198 |
| Atoms | 19 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 7 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
