Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3934610973
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 | 36 USD | 95 | 10 working days | Get Quote |
| 5 mg | 36 USD | 95 | 10 working days | Get Quote |
| 10 mg | 36 USD | 95 | 10 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-3860265109
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3934610973.sdf |
| SMILES | MCULE-3934610973.smiles |
| Standard InChI | MCULE-3934610973.inchi |
| InChIKey | MCULE-3934610973.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867669407 | 95 | As is | in stock |
| P-875843307 | N/A | As is | in stock |
| P-869211158 | 95 | As is | in stock |
| P-903215404 | 95 | As is | 1000 mg |
| P-851747884 | N/A | As is | by synthesis |
| P-889815970 | 95 | As is | by synthesis |
| P-611075185 | 95 | As is | by synthesis |
| P-901534257 | 95 | As is | by synthesis |
| P-616225801 | 95 | As is | in stock |
| P-4148049 | 90 | As is | 100 mg |
| P-861397198 | 95 | As is | by synthesis |
| P-855950449 | 95 | As is | 5 g |
| P-852395705 | N/A | As is | in stock |
| P-854868538 | 95 | As is | by synthesis |
| P-502385456 | 90 | As is | in stock |
| P-611451382 | 90 | As is | in stock |
| P-617790072 | 90 | As is | 1.774 g |
| P-617722088 | 90 | As is | 1.774 g |
| P-893673915 | 95 | As is | by synthesis |
| P-886608523 | 95 | Main component | in stock |
| P-875793571 | N/A | Main component | in stock |
| P-613855716 | 95 | Main component | in stock |
| P-903145425 | 95 | Main component | 2.5 g |
| P-580261071 | 95 | Main component | by synthesis |
| P-851721161 | N/A | Main component | by synthesis |
| P-489153533 | 97 | Main component | in stock |
| P-589661055 | 95 | Main component | by resynthesis (? - ? days) |
| P-901500471 | 95 | Main component | by synthesis |
| P-868599651 | 96 | Main component | in stock |
| P-580290673 | N/A | Main component | by resynthesis (? - ? days) |
| P-502472993 | 95 | Main component | by synthesis |
| P-588249638 | N/A | Main component | by synthesis |
| P-864072121 | 95 | Main component | by synthesis |
| P-424917919 | 90 | Main component | in stock |
| P-873224918 | 90 | Main component | in stock |
| P-611594390 | 90 | Main component | in stock |
| P-893834418 | 95 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 201.691 |
| logP | 3.4364 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 35.25 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 57.1864 |
| Atoms | 29 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 16 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
