Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5159827945
Compound
Show structure
In order to add this molecule to a collection you have to create an account.
Sign up for free
- 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 | 14 USD | 95 | 20 working days | Get Quote |
| 5 mg | 14 USD | 95 | 20 working days | Get Quote |
| 10 mg | 14 USD | 95 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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-9951518727
- Component type: Main
-
MCULE-2723105288
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5159827945.sdf |
| SMILES | MCULE-5159827945.smiles |
| Standard InChI | MCULE-5159827945.inchi |
| InChIKey | MCULE-5159827945.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867607715 | 95 | As is | in stock |
| P-875766403 | N/A | As is | in stock |
| P-588247631 | 95 | As is | in stock |
| P-903104676 | 98 | As is | 50 g |
| P-610978964 | 90 | As is | 240.368 g |
| P-580238896 | 95 | As is | by synthesis |
| P-675222691 | 95 | As is | by resynthesis (? - ? days) |
| P-606873538 | N/A | As is | in stock |
| P-489126571 | 97 | As is | in stock |
| P-596961419 | 95 | As is | 50 g |
| P-869818004 | 90 | As is | 1000 mg |
| P-864103071 | 95 | As is | in stock |
| P-580697941 | 95 | As is | 5.125 g |
| P-893255317 | 95 | As is | by synthesis |
| P-454763309 | 90 | As is | in stock |
| P-851265245 | 95 | As is | by synthesis |
| P-868580810 | 98 | As is | in stock |
| P-34603017 | 90 | As is | in stock |
| P-580781664 | 90 | As is | by resynthesis (? - ? days) |
| P-580770593 | 90 | As is | in stock |
| P-861951562 | 95 | As is | 103.458 g |
| P-905331423 | 95 | As is | 2 g |
| P-454322545 | 90 | As is | 850 mg |
| P-563588188 | 95 | As is | 250 mg |
| P-563587679 | 95 | As is | 1000 mg |
| P-856079849 | 95 | As is | by resynthesis (? - ? days) |
| P-860792139 | N/A | As is | by synthesis |
| P-852424123 | N/A | As is | in stock |
| P-854747246 | 95 | As is | in stock |
| P-888859560 | N/A | As is | in stock |
| P-500399649 | 97 | As is | by synthesis |
| P-596797154 | 95 | As is | by synthesis |
| P-519851461 | 90 | As is | in stock |
| P-906863132 | 95 | As is | by synthesis |
| P-611392373 | 90 | As is | in stock |
| P-615453902 | 95 | As is | in stock |
| P-886586711 | 95 | As a main component | in stock |
| P-889915401 | N/A | As a main component | by synthesis |
| P-869259835 | 95 | As a main component | in stock |
| P-903112809 | 95 | As a main component | 2.5 g |
| P-492323391 | 95 | As a main component | in stock |
| P-893558192 | 90 | As a main component | 10 g |
| P-851866589 | N/A | As a main component | by synthesis |
| P-864251767 | 95 | As a main component | by synthesis |
| P-591060924 | 95 | As a main component | by synthesis |
| P-901539652 | 95 | As a main component | by synthesis |
| P-674290442 | 90 | As a main component | in stock |
| P-619313957 | 90 | As a main component | 25 mg |
| P-851287480 | 95 | As a main component | by synthesis |
| P-861344834 | 95 | As a main component | by synthesis |
| P-34718884 | 90 | As a main component | in stock |
| P-596547232 | 95 | As a main component | 1.095 g |
| P-596546255 | 95 | As a main component | 100 mg |
| P-870640628 | 95 | As a main component | 250 mg |
| P-454414617 | 95 | As a main component | 1.095 g |
| P-563394405 | 97 | As a main component | 5 g |
| P-596574348 | 95 | As a main component | 250 mg |
| P-563399641 | 95 | As a main component | 25 g |
| P-580496497 | N/A | As a main component | by synthesis |
| P-854795013 | 95 | As a main component | by synthesis |
| P-889883889 | 95 | As a main component | by synthesis |
| P-873215055 | 90 | As a main component | in stock |
| P-611392374 | 90 | As a main component | in stock |
| P-893778110 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 165.207 |
| logP | 2.579 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 12.03 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 50.3897 |
| Atoms | 24 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 12 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
