Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7062752938
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 | 13 USD | 96 | 9 working days | Get Quote |
| 5 mg | 13 USD | 96 | 9 working days | Get Quote |
| 10 mg | 13 USD | 96 | 9 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-7062752938.sdf |
| SMILES | MCULE-7062752938.smiles |
| Standard InChI | MCULE-7062752938.inchi |
| InChIKey | MCULE-7062752938.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867574631 | 98 | As is | in stock |
| P-875735196 | 95 | As is | in stock |
| P-1275147400 | 95 | As is | in stock |
| P-1275200279 | 97 | As is | in stock |
| P-617061305 | 98 | As is | in stock |
| P-864109644 | 95 | As is | in stock |
| P-901536392 | 95 | As is | by synthesis |
| P-851251214 | 95 | As is | by synthesis |
| P-868609868 | 96 | As is | in stock |
| P-580356323 | 95 | As is | by resynthesis (? - ? days) |
| P-454396511 | 95 | As is | 25 g |
| P-856008385 | 95 | As is | 100 mg |
| P-579623542 | 98 | As is | in stock |
| P-852439052 | 97 | As is | by synthesis |
| P-889882399 | 95 | As is | by synthesis |
| P-498727849 | 97 | As is | 132.79 g |
| P-1271632888 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 357.118 |
| logP | 5.3357 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 10 |
| PSA | 13.14 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 84.951 |
| Atoms | 48 |
| Rings | 1 |
| Heavy atoms | 18 |
| Hydrogen atoms | 30 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| Inorganic atoms | 1 |
| 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 |
