Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7170659062
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 | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 USD | 98 | 14 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-9199801639
- Component type: Main
-
1
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7170659062.sdf |
| SMILES | MCULE-7170659062.smiles |
| Standard InChI | MCULE-7170659062.inchi |
| InChIKey | MCULE-7170659062.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1275175954 | 99 | Main component | in stock |
| P-1275184464 | 97 | Main component | in stock |
| P-903204878 | 98 | Main component | 3.5 kg |
| P-1270337404 | 98 | Main component | in stock |
| P-606914023 | N/A | Main component | in stock |
| P-1273455941 | 95 | Main component | by resynthesis (? - ? days) |
| P-895931384 | 95 | Main component | by resynthesis (? - ? days) |
| P-892504989 | 95 | Main component | 9 g |
| P-901445444 | 95 | Main component | by synthesis |
| P-901465058 | 95 | Main component | by synthesis |
| P-868610105 | 98 | Main component | in stock |
| P-905359120 | 98 | Main component | 700 g |
| P-1264316815 | 98 | Main component | 3.92613 kg |
| P-500418281 | 98 | Main component | in stock |
| P-608220295 | 98 | Main component | in stock |
| P-500418280 | 98 | Main component | in stock |
| P-608221005 | 98 | Main component | in stock |
| P-505537632 | 95 | Main component | in stock |
| P-502533038 | 95 | Main component | by synthesis |
| P-890848073 | 95 | Main component | in stock |
| P-502945828 | 90 | Main component | in stock |
| P-524162693 | 98 | Main component | 500 g |
| P-524164595 | 98 | Main component | 500 g |
| P-31275317 | 90 | Main component | 10 g |
| P-856039907 | 90 | Main component | 10 g |
| P-613282281 | 95 | Main component | by synthesis |
| P-580470834 | N/A | Main component | by synthesis |
| P-904720834 | 90 | Main component | in stock |
| P-902971291 | 95 | Main component | by synthesis |
| P-902982584 | 95 | Main component | by synthesis |
| P-608280169 | 98 | Main component | in stock |
| P-492279898 | 95 | Main component | 190.8 g |
| P-885519144 | 95 | Main component | by synthesis |
| P-19701416 | 90 | Main component | in stock |
| P-904258518 | 95 | Main component | in stock |
| P-869164422 | 95 | Main component | 1000 mg |
| P-892300408 | 95 | Main component | 1000 mg |
| P-888659598 | 95 | Main component | 1000 mg |
| P-33801475 | 94 | Main component | by resynthesis (? - ? days) |
| P-906777637 | 99 | Main component | by synthesis |
| P-906751641 | 98 | Main component | by synthesis |
| P-611415114 | 90 | Main component | in stock |
| P-1271605676 | 97 | Main component | in stock |
| P-904556750 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-851734562 | N/A | Main component as a main component | by synthesis |
| P-1275085518 | 95 | Main component as a main component | 500 g |
| P-895529138 | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 139.128 |
| logP | -0.5801 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 66.15 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 28.6859 |
| Atoms | 19 |
| Rings | 0 |
| Heavy atoms | 9 |
| Hydrogen atoms | 10 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
