Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8851323328
Compound
Show structures
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 | 7 USD | 98 | 20 working days | Get Quote |
| 5 mg | 7 USD | 98 | 20 working days | Get Quote |
| 10 mg | 7 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-6025598058
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8851323328.sdf |
| SMILES | MCULE-8851323328.smiles |
| Standard InChI | MCULE-8851323328.inchi |
| InChIKey | MCULE-8851323328.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867603879 | 98 | As is | in stock |
| P-1275146390 | 98 | As is | in stock |
| P-1275168488 | 99 | As is | in stock |
| P-874638918 | 95 | As is | by resynthesis (? - ? days) |
| P-1270273064 | 98 | As is | in stock |
| P-606874214 | N/A | As is | in stock |
| P-596959866 | 98 | As is | 1000 g |
| P-864152983 | 95 | As is | in stock |
| P-893252005 | 95 | As is | by synthesis |
| P-619328498 | 90 | As is | 153 mg |
| P-425228796 | 90 | As is | in stock |
| P-580304752 | 95 | As is | by resynthesis (? - ? days) |
| P-889440137 | 98 | As is | 2.4712 kg |
| P-1264368998 | 98 | As is | 200 g |
| P-579491286 | 90 | As is | 22.5 g |
| P-502618934 | 90 | As is | in stock |
| P-524188835 | 98 | As is | 100 g |
| P-856007595 | 98 | As is | 100 mg |
| P-31194911 | 90 | As is | unavailable |
| P-35290514 | 90 | As is | in stock |
| P-500402241 | 98 | As is | by synthesis |
| P-859962050 | 95 | As is | by synthesis |
| P-896073765 | N/A | As is | 3.47 g |
| P-502327216 | 90 | As is | in stock |
| P-22443122 | 90 | As is | 60 mg |
| P-1272903666 | 94 | As is | by resynthesis (? - ? days) |
| P-906780787 | 98 | As is | by synthesis |
| P-1271665256 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 268.310 |
| logP | 2.6358 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 65.18 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 81.732 |
| Atoms | 36 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 16 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 | 2 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 2 |
| Undefined stereo double bonds | 0 |
