MCULE-3205190994-0
- 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 | 55 USD | 97 | 15 working days | Get Quote |
| 5 mg | 55 USD | 97 | 15 working days | Get Quote |
| 10 mg | 55 USD | 97 | 15 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-4938478059-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3205190994-0.sdf |
| SMILES | MCULE-3205190994-0.smiles |
| Standard InChI | MCULE-3205190994-0.inchi |
| InChIKey | MCULE-3205190994-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867607568 | 95 | As is | in stock |
| P-875766664 | N/A | As is | in stock |
| P-890257451 | 97 | As is | by synthesis |
| P-597015639 | 95 | As is | in stock |
| P-579779145 | 99 | As is | in stock |
| P-903104010 | 97 | As is | 5 g |
| P-905502033 | 97 | As is | by synthesis |
| P-610977332 | 90 | As is | 9.3902 kg |
| P-580261441 | 95 | As is | by synthesis |
| P-892510540 | N/A | As is | in stock |
| P-489184930 | 97 | As is | in stock |
| P-596976740 | 97 | As is | 25 g |
| P-864111281 | 97 | As is | in stock |
| P-861317470 | 97 | As is | 16.87 g |
| P-901413650 | 95 | As is | in stock |
| P-851271074 | 95 | As is | by synthesis |
| P-861277537 | 95 | As is | in stock |
| P-896544323 | 95 | As is | in stock |
| P-580405057 | 95 | As is | by resynthesis (? - ? days) |
| P-500248797 | N/A | As is | in stock |
| P-579719268 | 95 | As is | in stock |
| P-505517806 | 95 | As is | in stock |
| P-500152225 | 96 | As is | in stock |
| P-454321034 | 95 | As is | 100 mg |
| P-454402088 | 95 | As is | 5 g |
| P-608100459 | 97 | As is | unavailable |
| P-580483245 | N/A | As is | by synthesis |
| P-852451665 | N/A | As is | in stock |
| P-854912379 | 95 | As is | by synthesis |
| P-888904758 | N/A | As is | in stock |
| P-500404421 | 97 | As is | by synthesis |
| P-859985154 | 95 | As is | by synthesis |
| P-904081466 | 97 | As is | 19 g |
| P-502339558 | 90 | As is | in stock |
| P-906862845 | 97 | As is | by synthesis |
| P-615394032 | 95 | As is | in stock |
| P-867660101 | 98 | As a main component | in stock |
| P-875828389 | N/A | As a main component | in stock |
| P-869246772 | 98 | As a main component | in stock |
| P-903202976 | 99 | As a main component | 3 g |
| P-893596722 | 90 | As a main component | 2.95 g |
| P-617051549 | 95 | As a main component | by resynthesis (? - ? days) |
| P-851450856 | N/A | As a main component | by synthesis |
| P-489214663 | 97 | As a main component | in stock |
| P-888822187 | 99 | As a main component | unavailable |
| P-864125969 | 95 | As a main component | in stock |
| P-590799701 | 95 | As a main component | by synthesis |
| P-851269209 | 95 | As a main component | by synthesis |
| P-893634547 | 95 | As a main component | by synthesis |
| P-580432844 | 95 | As a main component | by resynthesis (? - ? days) |
| P-675311704 | 95 | As a main component | by synthesis |
| P-889759941 | 96 | As a main component | in stock |
| P-563497492 | 95 | As a main component | 5 g |
| P-856090526 | 95 | As a main component | 25 g |
| P-580479779 | N/A | As a main component | by synthesis |
| P-428002150 | 95 | As a main component | 10.073 kg |
| P-854919265 | 95 | As a main component | by synthesis |
| P-906888010 | 98 | As a main component | by synthesis |
| P-611601806 | 90 | As a main component | in stock |
| P-886954475 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 177.199 |
| logP | 1.2676 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 48.3912 |
| Atoms | 24 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 11 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |

