MCULE-5840092627
- 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 | 22 working days | Get Quote |
| 5 mg | 6 USD | 98 | 22 working days | Get Quote |
| 10 mg | 6 USD | 98 | 22 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-9820895528
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5840092627.sdf |
| SMILES | MCULE-5840092627.smiles |
| Standard InChI | MCULE-5840092627.inchi |
| InChIKey | MCULE-5840092627.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867431266 | N/A | As is | by synthesis |
| P-864323759 | 95 | As is | by synthesis |
| P-870652247 | N/A | As is | in stock |
| P-505492142 | 95 | As is | in stock |
| P-31194452 | 90 | As is | 500 mg |
| P-895200163 | 95 | As is | by synthesis |
| P-885533479 | 95 | As is | by synthesis |
| P-869107765 | 95 | As is | by synthesis |
| P-888626800 | 95 | As is | unavailable |
| P-867572944 | 98 | As a main component | in stock |
| P-875733697 | N/A | As a main component | in stock |
| P-590379836 | 98 | As a main component | in stock |
| P-903063284 | 98 | As a main component | 500 g |
| P-893575609 | 90 | As a main component | 1.50899 kg |
| P-606907310 | N/A | As a main component | in stock |
| P-489158627 | 97 | As a main component | in stock |
| P-596950265 | 98 | As a main component | 500 g |
| P-580194788 | 98 | As a main component | in stock |
| P-864184229 | 95 | As a main component | in stock |
| P-580719286 | 98 | As a main component | 140 g |
| P-893224237 | 95 | As a main component | in stock |
| P-851268342 | 95 | As a main component | by synthesis |
| P-580450201 | 99 | As a main component | in stock |
| P-868617412 | 98 | As a main component | in stock |
| P-579476617 | 95 | As a main component | in stock |
| P-870652248 | N/A | As a main component | in stock |
| P-505498140 | 95 | As a main component | in stock |
| P-856009668 | 98 | As a main component | 100 mg |
| P-896628572 | 95 | As a main component | by synthesis |
| P-854716063 | 95 | As a main component | in stock |
| P-584616446 | 95 | As a main component | in stock |
| P-608275038 | 98 | As a main component | in stock |
| P-500376372 | 98 | As a main component | by synthesis |
| P-1263956554 | 90 | As a main component | in stock |
| P-579711105 | N/A | As a main component | in stock |
| P-869107764 | 95 | As a main component | by synthesis |
| P-892286360 | 95 | As a main component | unavailable |
| P-888626799 | 95 | As a main component | 51 mg |
| P-873223672 | 90 | As a main component | in stock |
| P-906864025 | 98 | As a main component | by synthesis |
| P-611483921 | 90 | As a main component | in stock |
| P-855294926 | 90 | As a main component | in stock |
| P-615403899 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 307.384 |
| logP | 2.709 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 8 |
| PSA | 48.0 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 89.6515 |
| Atoms | 47 |
| Rings | 2 |
| Heavy atoms | 22 |
| Hydrogen atoms | 25 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |

