Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3645636799
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 | 5 USD | 98 | 14 working days | Get Quote |
| 5 mg | 5 USD | 98 | 14 working days | Get Quote |
| 10 mg | 5 USD | 98 | 14 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-2213819614
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3645636799.sdf |
| SMILES | MCULE-3645636799.smiles |
| Standard InChI | MCULE-3645636799.inchi |
| InChIKey | MCULE-3645636799.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867581915 | 98 | As is | in stock |
| P-875740773 | 98 | As is | in stock |
| P-1275154280 | 95 | As is | in stock |
| P-1275191453 | 98 | As is | in stock |
| P-903071287 | 98 | As is | 3.5 kg |
| P-905477587 | 98 | As is | 100 g |
| P-1270394270 | 98 | As is | in stock |
| P-580239960 | 95 | As is | by synthesis |
| P-617066931 | 95 | As is | in stock |
| P-606910081 | N/A | As is | in stock |
| P-489143698 | 97 | As is | in stock |
| P-596952917 | 98 | As is | 4 kg |
| P-494348651 | 95 | As is | 74 g |
| P-596491792 | 90 | As is | 257 mg |
| P-596399417 | 90 | As is | 257 mg |
| P-864087874 | 97 | As is | in stock |
| P-481169421 | 95 | As is | 100 g |
| P-580707437 | 98 | As is | 2.1 kg |
| P-505577845 | 98 | As is | in stock |
| P-454721083 | 90 | As is | in stock |
| P-436464560 | 95 | As is | in stock |
| P-851244914 | 95 | As is | by synthesis |
| P-861278855 | 95 | As is | in stock |
| P-868559996 | 98 | As is | in stock |
| P-580425909 | 95 | As is | by resynthesis (? - ? days) |
| P-905333301 | 97 | As is | 1.2 kg |
| P-861967070 | 97 | As is | 12.698 kg |
| P-505516137 | 95 | As is | in stock |
| P-502451819 | 95 | As is | by synthesis |
| P-488547060 | 90 | As is | in stock |
| P-12568939 | 92 | As is | 300 mg |
| P-500163355 | 96 | As is | in stock |
| P-454390819 | 95 | As is | 159 mg |
| P-454295238 | 95 | As is | 159 mg |
| P-579617345 | 98 | As is | in stock |
| P-500222527 | 98 | As is | in stock |
| P-1267087417 | 95 | As is | 2.5 g |
| P-14057095 | 95 | As is | unavailable |
| P-581745307 | 95 | As is | in stock |
| P-852394962 | N/A | As is | by synthesis |
| P-1272568872 | N/A | As is | in stock |
| P-428003528 | 95 | As is | in stock |
| P-904721402 | 90 | As is | in stock |
| P-855402478 | 95 | As is | in stock |
| P-454370906 | 92 | As is | in stock |
| P-13265453 | 92 | As is | 300 mg |
| P-500407003 | 98 | As is | by synthesis |
| P-885515909 | 95 | As is | by synthesis |
| P-519909973 | 90 | As is | in stock |
| P-896073691 | N/A | As is | 99 mg |
| P-596756184 | 97 | As is | 2.214 kg |
| P-502348875 | 90 | As is | in stock |
| P-33517118 | 94 | As is | by resynthesis (? - ? days) |
| P-906904448 | 98 | As is | in stock |
| P-1279169974 | 98 | As is | in stock |
| P-894631988 | 95 | As a main component | by resynthesis (? - ? days) |
| P-893392432 | 90 | As a main component | by synthesis |
| P-851576389 | N/A | As a main component | by synthesis |
| P-617430663 | 98 | As a main component | by synthesis |
| P-854815877 | 95 | As a main component | by synthesis |
| P-1279403613 | 98 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 157.553 |
| logP | 1.4332 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 50.19 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 36.2063 |
| Atoms | 14 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 4 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
