Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7611407286
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 | 26 USD | 98 | 16 working days | Get Quote |
| 5 mg | 42 USD | 98 | 16 working days | Get Quote |
| 10 mg | 58 USD | 98 | 16 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-7003471840
- Component type: Main
-
1
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7611407286.sdf |
| SMILES | MCULE-7611407286.smiles |
| Standard InChI | MCULE-7611407286.inchi |
| InChIKey | MCULE-7611407286.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-895195693 | 95 | As is | by synthesis |
| P-867544871 | N/A | Main component | in stock |
| P-875701888 | 95 | Main component | in stock |
| P-869373771 | 95 | Main component | by resynthesis (? - ? days) |
| P-903026465 | 98 | Main component | 125 mg |
| P-606892028 | N/A | Main component | in stock |
| P-596939505 | 98 | Main component | 50 mg |
| P-1273450533 | 95 | Main component | by resynthesis (? - ? days) |
| P-864174275 | 98 | Main component | in stock |
| P-890225712 | 95 | Main component | by synthesis |
| P-580450913 | 99 | Main component | in stock |
| P-861378153 | 95 | Main component | by synthesis |
| P-608495714 | 95 | Main component | in stock |
| P-861976926 | 98 | Main component | 262 mg |
| P-870659810 | N/A | Main component | in stock |
| P-870659861 | N/A | Main component | in stock |
| P-1273109935 | 97 | Main component | 100 mg |
| P-904640892 | 95 | Main component | by synthesis |
| P-854715777 | 95 | Main component | in stock |
| P-871074883 | 95 | Main component | in stock |
| P-878640727 | 98 | Main component | in stock |
| P-885540955 | 95 | Main component | by synthesis |
| P-892293540 | 95 | Main component | unavailable |
| P-869155447 | 95 | Main component | 50 mg |
| P-888652477 | 95 | Main component | 50 mg |
| P-611419224 | 90 | Main component | in stock |
| P-666985336 | 98 | Main component | in stock |
| P-867568872 | 98 | Main component as a main component | in stock |
| P-875729769 | 98 | Main component as a main component | in stock |
| P-611407148 | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 231.180 |
| logP | 0.0089 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 103.45 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 50.4012 |
| Atoms | 26 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 10 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 1 |
| 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 |
