Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
UNKNOWN STEREO
MCULE-6865432074
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 | 95 | 22 working days | Get Quote |
| 5 mg | 6 USD | 95 | 22 working days | Get Quote |
| 10 mg | 6 USD | 95 | 22 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-8384465258
- Component type: Main
-
1
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6865432074.sdf |
| SMILES | MCULE-6865432074.smiles |
| Standard InChI | MCULE-6865432074.inchi |
| InChIKey | MCULE-6865432074.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875730110 | N/A | As is | in stock |
| P-887311137 | N/A | As is | in stock |
| P-596982961 | 98 | As is | 300 g |
| P-864177591 | 98 | As is | in stock |
| P-868544521 | 98 | As is | in stock |
| P-893237071 | 95 | As is | in stock |
| P-854552978 | 95 | As is | 217 mg |
| P-500372800 | 98 | As is | by synthesis |
| P-867662060 | 95 | Main component | in stock |
| P-875831288 | N/A | Main component | in stock |
| P-535626574 | 95 | Main component | in stock |
| P-505389495 | 98 | Main component | in stock |
| P-505389707 | 98 | Main component | in stock |
| P-606905477 | N/A | Main component | in stock |
| P-596973058 | 98 | Main component | 400 g |
| P-864085736 | 97 | Main component | in stock |
| P-893219464 | 95 | Main component | in stock |
| P-893237151 | 95 | Main component | in stock |
| P-505509445 | 95 | Main component | in stock |
| P-488555915 | 92 | Main component | in stock |
| P-488543706 | 90 | Main component | in stock |
| P-524444064 | 97 | Main component | 981 mg |
| P-454363653 | 92 | Main component | in stock |
| P-500375533 | 98 | Main component | by synthesis |
| P-464689836 | 90 | Main component | 431 mg |
| P-2376540 | 90 | Main component | 431 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 255.226 |
| logP | -1.111 |
| H-bond acceptors | 6 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 102.96 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 52.1845 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 10 |
| Heteroatoms | 8 |
| N/O atoms | 6 |
| Inorganic atoms | 1 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
