Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1802625270
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 | 20 USD | 98 | 22 working days | Get Quote |
| 5 mg | 34 USD | 98 | 16 working days | Get Quote |
| 10 mg | 50 USD | 98 | 16 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-1160274922
- Component type: Main
-
MCULE-3755343091
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1802625270.sdf |
| SMILES | MCULE-1802625270.smiles |
| Standard InChI | MCULE-1802625270.inchi |
| InChIKey | MCULE-1802625270.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1264389813 | 95 | As is | by synthesis |
| P-867540475 | 98 | As a main component | in stock |
| P-875696375 | N/A | As a main component | in stock |
| P-595214151 | 95 | As a main component | in stock |
| P-903019109 | 98 | As a main component | 300 mg |
| P-893472655 | 90 | As a main component | 1.952 g |
| P-596937872 | 98 | As a main component | 200 mg |
| P-864150144 | 95 | As a main component | in stock |
| P-860056633 | 98 | As a main component | by synthesis |
| P-868543712 | 99 | As a main component | in stock |
| P-893230500 | 95 | As a main component | in stock |
| P-851278842 | 95 | As a main component | by synthesis |
| P-860799768 | 98 | As a main component | in stock |
| P-580451144 | 98 | As a main component | in stock |
| P-861368392 | 95 | As a main component | by synthesis |
| P-579481044 | 95 | As a main component | in stock |
| P-870659665 | N/A | As a main component | in stock |
| P-868078671 | 95 | As a main component | in stock |
| P-596583277 | 97 | As a main component | 5 mg |
| P-854719747 | 95 | As a main component | in stock |
| P-474026765 | 95 | As a main component | in stock |
| P-608271083 | 98 | As a main component | in stock |
| P-889868671 | 95 | As a main component | by synthesis |
| P-579712836 | N/A | As a main component | in stock |
| P-869126893 | 95 | As a main component | by synthesis |
| P-892291128 | 95 | As a main component | 376 mg |
| P-888640130 | 95 | As a main component | 376 mg |
| P-906793160 | 98 | As a main component | by synthesis |
| P-855066914 | 90 | As a main component | in stock |
| P-481001902 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 366.452 |
| logP | 4.291 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 10 |
| PSA | 45.51 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 105.76 |
| Atoms | 53 |
| Rings | 3 |
| Heavy atoms | 27 |
| Hydrogen atoms | 26 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
