MCULE-6962938191
- 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 | 28 USD | 92 | 18 working days | Get Quote |
| 5 mg | 36 USD | 95 | 26 working days | Get Quote |
| 10 mg | 41 USD | 95 | 26 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.
| Name | File |
|---|---|
| SDF | MCULE-6962938191.sdf |
| SMILES | MCULE-6962938191.smiles |
| Standard InChI | MCULE-6962938191.inchi |
| InChIKey | MCULE-6962938191.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867291235 | 95 | As is | by synthesis |
| P-889902821 | N/A | As is | by synthesis |
| P-894615741 | 95 | As is | in stock |
| P-851654024 | N/A | As is | by synthesis |
| P-489112015 | 97 | As is | in stock |
| P-864219467 | 97 | As is | by synthesis |
| P-591083529 | 95 | As is | by synthesis |
| P-4032411 | 90 | As is | 25 mg |
| P-454642591 | 90 | As is | in stock |
| P-436476977 | 95 | As is | 6 g |
| P-861470563 | 97 | As is | by synthesis |
| P-579804975 | 90 | As is | in stock |
| P-580089841 | 95 | As is | 67.56 g |
| P-502981498 | 90 | As is | in stock |
| P-870580410 | 95 | As is | in stock |
| P-488553339 | 90 | As is | in stock |
| P-14015044 | 95 | As is | 300 mg |
| P-596596240 | 90 | As is | 1000 mg |
| P-852535680 | N/A | As is | in stock |
| P-854839158 | 95 | As is | by synthesis |
| P-26440126 | 90 | As is | 67.56 g |
| P-620225372 | 95 | As is | 67.56 g |
| P-454370344 | 92 | As is | in stock |
| P-23565223 | 92 | As is | 300 mg |
| P-856067637 | 95 | As is | in stock |
| P-424852545 | 90 | As is | in stock |
| P-611601137 | 90 | As is | in stock |
| P-464687159 | 90 | As is | 1.014 g |
| P-3133251 | 90 | As is | 1.014 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 212.290 |
| logP | 2.8247 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 19.03 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 72.3147 |
| Atoms | 32 |
| Rings | 3 |
| Heavy atoms | 16 |
| Hydrogen atoms | 16 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |

