Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4067803348
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 | 35 USD | 95 | 7 working days | Get Quote |
| 5 mg | 55 USD | 95 | 7 working days | Get Quote |
| 10 mg | 90 USD | 95 | 7 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.
-
MCULE-7850666223
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4067803348.sdf |
| SMILES | MCULE-4067803348.smiles |
| Standard InChI | MCULE-4067803348.inchi |
| InChIKey | MCULE-4067803348.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867646094 | N/A | As is | in stock |
| P-875813010 | N/A | As is | in stock |
| P-595211966 | 98 | As is | in stock |
| P-903175096 | 97 | As is | 1000 mg |
| P-893467577 | 90 | As is | 7.235 g |
| P-580234463 | 95 | As is | by synthesis |
| P-851843536 | N/A | As is | by synthesis |
| P-489238838 | 97 | As is | in stock |
| P-619197392 | 97 | As is | 1000 mg |
| P-864129623 | 95 | As is | in stock |
| P-591127823 | 95 | As is | by synthesis |
| P-861502298 | 95 | As is | by synthesis |
| P-563602069 | 95 | As is | 250 mg |
| P-852492796 | N/A | As is | in stock |
| P-854715405 | 95 | As is | in stock |
| P-871068233 | 95 | As is | in stock |
| P-888170773 | 98 | As is | by synthesis |
| P-888173014 | 98 | As is | by synthesis |
| P-888859830 | N/A | As is | in stock |
| P-613809205 | 95 | As is | in stock |
| P-498681446 | 95 | As is | 6 g |
| P-869109906 | 95 | As is | by synthesis |
| P-892287422 | 95 | As is | unavailable |
| P-888628372 | 95 | As is | 219 mg |
| P-611610223 | 90 | As is | in stock |
| P-575320332 | 95 | As is | in stock |
| P-860641060 | N/A | As a main component | by synthesis |
| P-869266770 | 95 | As a main component | in stock |
| P-610890195 | 90 | As a main component | by synthesis |
| P-851865147 | N/A | As a main component | by synthesis |
| P-864231021 | 95 | As a main component | by synthesis |
| P-870661650 | N/A | As a main component | in stock |
| P-873242809 | 97 | As a main component | 10 mg |
| P-563627242 | 95 | As a main component | 1000 mg |
| P-895202620 | 95 | As a main component | by synthesis |
| P-613805232 | 95 | As a main component | in stock |
| P-498684976 | 97 | As a main component | 0 mg |
| P-869137328 | 95 | As a main component | by synthesis |
| P-888645171 | 95 | As a main component | unavailable |
| P-855227626 | 90 | As a main component | in stock |
| P-886929023 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 228.114 |
| logP | 3.1831 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 12.03 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 63.0277 |
| Atoms | 25 |
| Rings | 3 |
| Heavy atoms | 14 |
| Hydrogen atoms | 11 |
| Heteroatoms | 3 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
