MCULE-6933013590
- 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.
-
MCULE-5180999844
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6933013590.sdf |
| SMILES | MCULE-6933013590.smiles |
| Standard InChI | MCULE-6933013590.inchi |
| InChIKey | MCULE-6933013590.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867579070 | 98 | As is | in stock |
| P-875738563 | N/A | As is | in stock |
| P-597027369 | 98 | As is | in stock |
| P-869183571 | 95 | As is | in stock |
| P-505403884 | 99 | As is | in stock |
| P-505389842 | 98 | As is | in stock |
| P-903068661 | 98 | As is | 1.5 kg |
| P-905479048 | 97 | As is | 1000 g |
| P-617065443 | N/A | As is | in stock |
| P-606903838 | N/A | As is | in stock |
| P-596951941 | 98 | As is | 2 kg |
| P-580195826 | 98 | As is | in stock |
| P-864110882 | 97 | As is | in stock |
| P-580716828 | 98 | As is | 665 g |
| P-901459096 | 95 | As is | by synthesis |
| P-868582954 | 98 | As is | in stock |
| P-580277010 | 95 | As is | by resynthesis (? - ? days) |
| P-862057090 | 97 | As is | 3.43918 kg |
| P-905350088 | 97 | As is | 151 g |
| P-596548753 | 97 | As is | 972 mg |
| P-579616588 | 98 | As is | 5 kg |
| P-896628927 | 95 | As is | by synthesis |
| P-854691506 | 95 | As is | in stock |
| P-474027530 | 95 | As is | in stock |
| P-608275093 | 98 | As is | in stock |
| P-617694498 | 90 | As is | 390 mg |
| P-578152107 | 90 | As is | 390 mg |
| P-885550354 | 95 | As is | by synthesis |
| P-617402614 | N/A | As is | in stock |
| P-464626228 | 95 | As is | by synthesis |
| P-869175473 | 95 | As is | in stock |
| P-892286825 | 95 | As is | 1.002 g |
| P-892310331 | 95 | As is | 1.002 g |
| P-906771604 | 99 | As is | by synthesis |
| P-611351109 | 90 | As is | in stock |
| P-611498621 | 90 | As is | in stock |
| P-615393237 | 95 | As is | in stock |
| P-901255601 | N/A | As a main component | in stock |
| P-616223397 | 95 | As a main component | in stock |
| P-869333601 | 95 | As a main component | in stock |
| P-903027234 | 97 | As a main component | 25 g |
| P-893459581 | 90 | As a main component | 190 g |
| P-901661269 | N/A | As a main component | in stock |
| P-865904513 | 97 | As a main component | 20 g |
| P-895936365 | 95 | As a main component | by resynthesis (? - ? days) |
| P-901917020 | 97 | As a main component | 24.39 g |
| P-868604968 | 98 | As a main component | in stock |
| P-870663180 | 98 | As a main component | in stock |
| P-852466712 | N/A | As a main component | in stock |
| P-906906306 | 97 | As a main component | in stock |
| P-666965921 | 95 | As a main component | in stock |
| P-886893021 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 139.176 |
| logP | 1.0041 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 88.77 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 29.7782 |
| Atoms | 17 |
| Rings | 0 |
| Heavy atoms | 8 |
| Hydrogen atoms | 9 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |

