Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7850736578
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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 20 USD | 95 | 10 working days | Get Quote |
| 10 mg | 20 USD | 95 | 10 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-7850736578.sdf |
| SMILES | MCULE-7850736578.smiles |
| Standard InChI | MCULE-7850736578.inchi |
| InChIKey | MCULE-7850736578.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867552662 | 95 | As is | in stock |
| P-875710868 | N/A | As is | in stock |
| P-613849668 | 95 | As is | in stock |
| P-903037161 | 97 | As is | 5 g |
| P-893542510 | 90 | As is | 16.5 g |
| P-851850754 | N/A | As is | by synthesis |
| P-873289892 | 97 | As is | 5 g |
| P-596403235 | 90 | As is | 1 mg |
| P-889492998 | 95 | As is | by synthesis |
| P-591117434 | 95 | As is | by synthesis |
| P-492256244 | 95 | As is | in stock |
| P-4151974 | 90 | As is | 100 mg |
| P-454691080 | 90 | As is | in stock |
| P-874588124 | 90 | As is | 787 mg |
| P-436445780 | 95 | As is | in stock |
| P-888187352 | 90 | As is | in stock |
| P-19930872 | 90 | As is | in stock |
| P-861521530 | 95 | As is | by synthesis |
| P-34735674 | 90 | As is | in stock |
| P-881674599 | N/A | As is | by resynthesis (? - ? days) |
| P-489247314 | 95 | As is | in stock |
| P-14046100 | 90 | As is | no data |
| P-13876756 | 90 | As is | in stock |
| P-13831581 | 95 | As is | 300 mg |
| P-596590129 | 90 | As is | 5 g |
| P-852394655 | N/A | As is | in stock |
| P-895278215 | 95 | As is | by synthesis |
| P-454373648 | 92 | As is | in stock |
| P-14034592 | 92 | As is | 300 mg |
| P-885525414 | 95 | As is | by synthesis |
| P-19575145 | 90 | As is | in stock |
| P-896169319 | 90 | As is | unavailable |
| P-502326827 | 90 | As is | in stock |
| P-22466490 | 90 | As is | 1000 mg |
| P-611396081 | 90 | As is | in stock |
| P-1097250 | 90 | As is | 806 mg |
| P-3233593 | 90 | As is | 806 mg |
| P-872756291 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 218.294 |
| logP | 3.3034 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 55.12 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 65.7636 |
| Atoms | 34 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 18 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
