MCULE-3871016226
- 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 | 13 USD | N/A | 9 working days | Get Quote |
| 5 mg | 16 USD | N/A | 9 working days | Get Quote |
| 10 mg | 19 USD | 99 | 20 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-2672558297
- Component type: Main
-
MCULE-7627105504
- Component type: Main
-
MCULE-7710863020
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3871016226.sdf |
| SMILES | MCULE-3871016226.smiles |
| Standard InChI | MCULE-3871016226.inchi |
| InChIKey | MCULE-3871016226.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867609155 | 99 | As is | in stock |
| P-875768340 | 99 | As is | in stock |
| P-597023745 | 97 | As is | in stock |
| P-869210534 | 98 | As is | in stock |
| P-874635064 | 95 | As is | in stock |
| P-903107363 | 98 | As is | 2 g |
| P-1264046945 | 95 | As is | in stock |
| P-893442560 | 90 | As is | 2.727 g |
| P-580269214 | 95 | As is | by synthesis |
| P-606940209 | N/A | As is | in stock |
| P-489140315 | 97 | As is | in stock |
| P-596961943 | 99 | As is | 2 g |
| P-580192574 | 98 | As is | in stock |
| P-864095101 | 97 | As is | in stock |
| P-860056519 | 98 | As is | by synthesis |
| P-580706150 | 99 | As is | 7.461 g |
| P-871219466 | N/A | As is | by resynthesis (? - ? days) |
| P-901554047 | 95 | As is | by synthesis |
| P-893236072 | 95 | As is | in stock |
| P-881634142 | 98 | As is | in stock |
| P-851246148 | 95 | As is | by synthesis |
| P-860797842 | 98 | As is | in stock |
| P-893620907 | 98 | As is | in stock |
| P-579478756 | 95 | As is | in stock |
| P-862060093 | 95 | As is | 1000 mg |
| P-500419360 | 98 | As is | in stock |
| P-505545019 | 95 | As is | in stock |
| P-563513624 | 97 | As is | 1000 mg |
| P-852465733 | N/A | As is | in stock |
| P-896627703 | 95 | As is | by synthesis |
| P-854713546 | 95 | As is | in stock |
| P-584624234 | 95 | As is | in stock |
| P-608269973 | 98 | As is | in stock |
| P-1263957911 | 90 | As is | in stock |
| P-579712863 | N/A | As is | in stock |
| P-869122069 | 95 | As is | by synthesis |
| P-892289951 | 95 | As is | 995 mg |
| P-888636589 | 95 | As is | 995 mg |
| P-906783064 | 98 | As is | by synthesis |
| P-611495489 | 90 | As is | in stock |
| P-611399548 | 90 | As is | in stock |
| P-855245845 | 90 | As is | in stock |
| P-480967680 | 95 | As is | in stock |
| P-612876364 | 97 | As a main component | by synthesis |
| P-889901982 | 97 | As a main component | by synthesis |
| P-875705522 | 98 | As a main component | in stock |
| P-869187682 | 95 | As a main component | in stock |
| P-505400030 | 98 | As a main component | in stock |
| P-590372666 | 97 | As a main component | in stock |
| P-903029993 | 97 | As a main component | 250 mg |
| P-903029994 | 99 | As a main component | 25 g |
| P-1264048930 | 95 | As a main component | in stock |
| P-881621627 | N/A | As a main component | by synthesis |
| P-606900275 | N/A | As a main component | in stock |
| P-596926660 | 95 | As a main component | 25 g |
| P-872724373 | 98 | As a main component | in stock |
| P-895926143 | 95 | As a main component | by resynthesis (? - ? days) |
| P-889463242 | 97 | As a main component | by synthesis |
| P-864152854 | 95 | As a main component | in stock |
| P-868544225 | 99 | As a main component | in stock |
| P-580719678 | 98 | As a main component | 2.4 g |
| P-901885158 | 95 | As a main component | by synthesis |
| P-893221204 | 95 | As a main component | in stock |
| P-851278490 | 95 | As a main component | by synthesis |
| P-860798511 | 98 | As a main component | in stock |
| P-580452514 | 98 | As a main component | in stock |
| P-861514166 | 95 | As a main component | by synthesis |
| P-868629083 | 98 | As a main component | in stock |
| P-579480467 | 95 | As a main component | in stock |
| P-579718009 | 95 | As a main component | in stock |
| P-905435554 | 99 | As a main component | 25 g |
| P-608219967 | 97 | As a main component | in stock |
| P-675216070 | 95 | As a main component | in stock |
| P-524184584 | 95 | As a main component | 1000 mg |
| P-524169275 | 98 | As a main component | 250 mg |
| P-580498605 | N/A | As a main component | by synthesis |
| P-852461474 | N/A | As a main component | in stock |
| P-474025951 | 95 | As a main component | in stock |
| P-608272341 | 98 | As a main component | in stock |
| P-889871479 | 95 | As a main component | by synthesis |
| P-889878060 | 95 | As a main component | by synthesis |
| P-579711377 | N/A | As a main component | in stock |
| P-869122082 | 95 | As a main component | by synthesis |
| P-892289952 | 95 | As a main component | 710 mg |
| P-888636600 | 95 | As a main component | 710 mg |
| P-906783152 | 95 | As a main component | by synthesis |
| P-906900075 | 99 | As a main component | in stock |
| P-893995595 | 95 | As a main component | in stock |
| P-615410345 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 502.782 |
| logP | 2.2644 |
| H-bond acceptors | 8 |
| H-bond donors | 6 |
| Rotatable bonds | 4 |
| PSA | 78.66 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 182.2082 |
| Atoms | 90 |
| Rings | 3 |
| Heavy atoms | 36 |
| Hydrogen atoms | 54 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| 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 |

