MCULE-4794673531-0
- 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 | 12 USD | 98 | 22 working days | Get Quote |
| 5 mg | 31 USD | 98 | 15 working days | Get Quote |
| 10 mg | 34 USD | 98 | 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-5096463543-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4794673531-0.sdf |
| SMILES | MCULE-4794673531-0.smiles |
| Standard InChI | MCULE-4794673531-0.inchi |
| InChIKey | MCULE-4794673531-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867616413 | 98 | As is | in stock |
| P-875777709 | N/A | As is | in stock |
| P-892786796 | 98 | As is | in stock |
| P-903120628 | 98 | As is | 750 mg |
| P-893591997 | 90 | As is | 15.462 g |
| P-606864638 | N/A | As is | in stock |
| P-489191960 | 97 | As is | in stock |
| P-619201582 | 98 | As is | 750 mg |
| P-580195678 | 98 | As is | in stock |
| P-889540216 | 97 | As is | in stock |
| P-860056180 | 98 | As is | by synthesis |
| P-868544416 | 99 | As is | in stock |
| P-873437495 | 98 | As is | 1.085 g |
| P-901426194 | 95 | As is | by synthesis |
| P-851247418 | 95 | As is | by synthesis |
| P-860799270 | 98 | As is | in stock |
| P-887240763 | 95 | As is | by synthesis |
| P-675216144 | 95 | As is | in stock |
| P-855916132 | 97 | As is | 50 mg |
| P-852522493 | N/A | As is | in stock |
| P-1263154695 | 95 | As is | by synthesis |
| P-854715741 | 95 | As is | in stock |
| P-584619482 | 95 | As is | in stock |
| P-474023876 | 95 | As is | in stock |
| P-608271502 | 98 | As is | in stock |
| P-596851899 | 95 | As is | by synthesis |
| P-904083901 | 95 | As is | 2.2 g |
| P-869146516 | 95 | As is | by synthesis |
| P-892293125 | 95 | As is | unavailable |
| P-888648907 | 95 | As is | 78 mg |
| P-906839934 | 98 | As is | by synthesis |
| P-611458064 | 90 | As is | in stock |
| P-855245816 | 90 | As is | in stock |
| P-893992514 | 95 | As is | in stock |
| P-867571437 | 98 | As a main component | in stock |
| P-875730990 | N/A | As a main component | in stock |
| P-874601039 | 98 | As a main component | in stock |
| P-595214755 | 95 | As a main component | in stock |
| P-903060559 | 98 | As a main component | 1.25 g |
| P-893618442 | 90 | As a main component | 3.823 g |
| P-606917980 | N/A | As a main component | in stock |
| P-865908096 | 98 | As a main component | 1.25 g |
| P-580193168 | 98 | As a main component | in stock |
| P-889569094 | 95 | As a main component | in stock |
| P-584630256 | 98 | As a main component | 1.228 g |
| P-901558217 | 95 | As a main component | by synthesis |
| P-881633921 | 98 | As a main component | in stock |
| P-860799743 | 98 | As a main component | in stock |
| P-861370816 | 95 | As a main component | by synthesis |
| P-579479562 | 95 | As a main component | in stock |
| P-855925116 | 97 | As a main component | 250 mg |
| P-1263154656 | 95 | As a main component | by synthesis |
| P-854714227 | 95 | As a main component | in stock |
| P-878641308 | 98 | As a main component | in stock |
| P-579712160 | N/A | As a main component | in stock |
| P-589631439 | N/A | As a main component | in stock |
| P-869160999 | 95 | As a main component | by synthesis |
| P-892295001 | 95 | As a main component | unavailable |
| P-888656227 | 95 | As a main component | 99 mg |
| P-906819286 | 98 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 417.503 |
| logP | 3.6469 |
| H-bond acceptors | 7 |
| H-bond donors | 1 |
| Rotatable bonds | 8 |
| PSA | 80.24 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 124.3697 |
| Atoms | 58 |
| Rings | 4 |
| Heavy atoms | 31 |
| Hydrogen atoms | 27 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| 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 |

