MCULE-2932088896
- 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 | 7 USD | 99 | 20 working days | Get Quote |
| 5 mg | 7 USD | 99 | 20 working days | Get Quote |
| 10 mg | 7 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-6154244493
- Component type: Main
-
MCULE-1962102238
- Component type: Main
-
MCULE-6851459722
- Component type: Main
-
MCULE-8613456333
- Component type: Main
-
MCULE-7293825693
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2932088896.sdf |
| SMILES | MCULE-2932088896.smiles |
| Standard InChI | MCULE-2932088896.inchi |
| InChIKey | MCULE-2932088896.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867643426 | 99 | As is | in stock |
| P-875809854 | N/A | As is | in stock |
| P-869181193 | 95 | As is | in stock |
| P-505351408 | 98 | As is | in stock |
| P-580241076 | 95 | As is | by synthesis |
| P-580241095 | 95 | As is | by synthesis |
| P-596969420 | 99 | As is | 2.99574 kg |
| P-864184098 | 95 | As is | in stock |
| P-893237691 | 95 | As is | in stock |
| P-893237703 | 95 | As is | in stock |
| P-861280580 | 97 | As is | in stock |
| P-580426782 | 95 | As is | by resynthesis (? - ? days) |
| P-505492413 | 95 | As is | in stock |
| P-492242521 | 95 | As is | in stock |
| P-488543791 | 90 | As is | in stock |
| P-13985882 | 95 | As is | 300 mg |
| P-904721466 | 90 | As is | in stock |
| P-12679912 | 90 | As is | 100 mg |
| P-454363730 | 92 | As is | in stock |
| P-892213654 | 95 | As is | by synthesis |
| P-869175377 | 95 | As is | in stock |
| P-892286505 | 95 | As is | 798 mg |
| P-892310035 | 95 | As is | 798 mg |
| P-611365972 | 90 | As is | in stock |
| P-867550617 | 95 | As a main component | in stock |
| P-875708391 | N/A | As a main component | in stock |
| P-875756860 | N/A | As a main component | in stock |
| P-869188579 | 97 | As a main component | in stock |
| P-505347376 | 99 | As a main component | in stock |
| P-590374355 | 98 | As a main component | in stock |
| P-597006514 | 98 | As a main component | 1.5 kg |
| P-596941539 | 98 | As a main component | 500 g |
| P-889551750 | 95 | As a main component | in stock |
| P-889585548 | 95 | As a main component | in stock |
| P-893238190 | 95 | As a main component | in stock |
| P-893262035 | 95 | As a main component | by synthesis |
| P-580444610 | 95 | As a main component | by resynthesis (? - ? days) |
| P-675217041 | 95 | As a main component | in stock |
| P-500399422 | 98 | As a main component | by synthesis |
| P-855051261 | 90 | As a main component | in stock |
| P-575293854 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 181.188 |
| logP | 1.0469 |
| H-bond acceptors | 4 |
| H-bond donors | 3 |
| Rotatable bonds | 3 |
| PSA | 83.55 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 47.5242 |
| Atoms | 24 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 11 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |

