Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
UNKNOWN STEREO
MCULE-5261590548
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 | 6 USD | 97 | 22 working days | Get Quote |
| 5 mg | 6 USD | 97 | 22 working days | Get Quote |
| 10 mg | 6 USD | 97 | 22 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.
-
1
MCULE-7791919887
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5261590548.sdf |
| SMILES | MCULE-5261590548.smiles |
| Standard InChI | MCULE-5261590548.inchi |
| InChIKey | MCULE-5261590548.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867638852 | 97 | As is | in stock |
| P-875804601 | 97 | As is | in stock |
| P-1275149999 | 95 | As is | in stock |
| P-1275161692 | 98 | As is | in stock |
| P-1270289599 | 97 | As is | in stock |
| P-606909387 | N/A | As is | in stock |
| P-596968380 | 97 | As is | 200 g |
| P-864170482 | 97 | As is | in stock |
| P-1271676218 | 97 | As is | in stock |
| P-867587456 | 97 | Main component | in stock |
| P-875746365 | 99 | Main component | in stock |
| P-580198756 | 95 | Main component | 92.5 g |
| P-606877951 | N/A | Main component | in stock |
| P-596931665 | 98 | Main component | 50 kg |
| P-864194130 | 95 | Main component | in stock |
| P-1274380541 | 95 | Main component | by synthesis |
| P-580450163 | 99 | Main component | in stock |
| P-580426758 | 95 | Main component | by resynthesis (? - ? days) |
| P-505495948 | 95 | Main component | in stock |
| P-505516500 | 95 | Main component | in stock |
| P-890849863 | 95 | Main component | in stock |
| P-619559383 | 90 | Main component | 1.339 g |
| P-613282425 | 95 | Main component | by synthesis |
| P-620223277 | 95 | Main component | 1000 mg |
| P-620068198 | 90 | Main component | 1000 mg |
| P-869178799 | 95 | Main component | in stock |
| P-892276736 | 95 | Main component | 3.5 g |
| P-892300909 | 95 | Main component | 2.5 g |
| P-892352839 | 95 | Main component | 2.5 g |
| P-1271643740 | 98 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 125.553 |
| logP | 0.9205 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 27.9792 |
| Atoms | 15 |
| Rings | 0 |
| Heavy atoms | 7 |
| Hydrogen atoms | 8 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
