MCULE-7938148356
- 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 | 78 USD | 90 | 30 working days | Get Quote |
| 5 mg | 84 USD | 90 | 30 working days | Get Quote |
| 10 mg | 91 USD | 90 | 30 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.
-
MCULE-1020330833
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7938148356.sdf |
| SMILES | MCULE-7938148356.smiles |
| Standard InChI | MCULE-7938148356.inchi |
| InChIKey | MCULE-7938148356.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886564910 | 93 | As is | in stock |
| P-889907318 | N/A | As is | by synthesis |
| P-903081215 | 93 | As is | 10 g |
| P-864252055 | 95 | As is | by synthesis |
| P-861507946 | 95 | As is | by synthesis |
| P-590339249 | 90 | As is | 1000 mg |
| P-890216819 | 90 | As is | in stock |
| P-859993905 | 95 | As is | by synthesis |
| P-893811469 | 95 | As is | by synthesis |
| P-867661921 | 95 | As a main component | in stock |
| P-875830188 | N/A | As a main component | in stock |
| P-903206299 | 95 | As a main component | 1000 mg |
| P-893430317 | 90 | As a main component | by synthesis |
| P-864272979 | 95 | As a main component | by synthesis |
| P-901467317 | 95 | As a main component | by synthesis |
| P-616226678 | 95 | As a main component | in stock |
| P-4142441 | 90 | As a main component | 100 mg |
| P-861505068 | 95 | As a main component | by synthesis |
| P-611602981 | 90 | As a main component | in stock |
| P-886924751 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 179.258 |
| logP | 2.6753 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 35.25 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 55.0284 |
| Atoms | 30 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 17 |
| 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 |

