Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5310743535
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 | 28 USD | 92 | 18 working days | Get Quote |
| 5 mg | 43 USD | 92 | 18 working days | Get Quote |
| 10 mg | 54 USD | 92 | 18 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.
-
1
MCULE-6944198613
- Component type: Main
-
1
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5310743535.sdf |
| SMILES | MCULE-5310743535.smiles |
| Standard InChI | MCULE-5310743535.inchi |
| InChIKey | MCULE-5310743535.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-675516738 | 90 | As is | by synthesis |
| P-852143389 | N/A | Main component | by synthesis |
| P-889996180 | N/A | Main component | by synthesis |
| P-904615441 | 95 | Main component | in stock |
| P-893469906 | 90 | Main component | 485 mg |
| P-851410449 | N/A | Main component | by synthesis |
| P-590735702 | 95 | Main component | by synthesis |
| P-666913558 | 90 | Main component | 5 mg |
| P-502447334 | 95 | Main component | by synthesis |
| P-502596970 | 90 | Main component | in stock |
| P-492214235 | 95 | Main component | in stock |
| P-601065401 | 90 | Main component | 480 mg |
| P-14055525 | 95 | Main component | 480 mg |
| P-852506602 | N/A | Main component | in stock |
| P-895332274 | 95 | Main component | by synthesis |
| P-13253884 | 92 | Main component | 300 mg |
| P-856064156 | 95 | Main component | in stock |
| P-868126172 | 90 | Main component | in stock |
| P-896080060 | N/A | Main component | 9.326 g |
| P-33815742 | 90 | Main component | in stock |
| P-502350382 | 90 | Main component | in stock |
| P-907285540 | 94 | Main component | by resynthesis (? - ? days) |
| P-907190485 | 94 | Main component | by resynthesis (? - ? days) |
| P-855253760 | 90 | Main component | in stock |
| P-675256528 | 95 | Main component as a main component | by synthesis |
| P-580008200 | 90 | Main component as a main component | in stock |
| P-675486027 | 95 | Main component as a main component | in stock |
| P-613332460 | 95 | Main component as a main component | by synthesis |
| P-13305074 | 92 | Main component as a main component | 300 mg |
| P-907298231 | 94 | Main component as a main component | by resynthesis (? - ? days) |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 204.198 |
| logP | 0.1317 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 57.2 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 45.4655 |
| Atoms | 27 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 13 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 1 |
| Halogen atoms | 0 |
| 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 |
