Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8643945757
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 | 11 USD | 98 | 14 working days | Get Quote |
| 5 mg | 21 USD | 98 | 14 working days | Get Quote |
| 10 mg | 33 USD | 98 | 22 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-5959110753
- Component type: Main
-
MCULE-2802306875
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-8643945757.sdf |
| SMILES | MCULE-8643945757.smiles |
| Standard InChI | MCULE-8643945757.inchi |
| InChIKey | MCULE-8643945757.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867569656 | 98 | As is | in stock |
| P-875730082 | 98 | As is | in stock |
| P-590359903 | 98 | As is | by resynthesis (? - ? days) |
| P-872724809 | 98 | As is | in stock |
| P-903059012 | 98 | As is | 5 g |
| P-610958840 | 90 | As is | 26.025 g |
| P-1270320085 | 98 | As is | in stock |
| P-606915924 | N/A | As is | in stock |
| P-489196685 | 97 | As is | in stock |
| P-596948975 | 98 | As is | 5 g |
| P-1273262046 | 95 | As is | by resynthesis (? - ? days) |
| P-864125531 | 95 | As is | in stock |
| P-580718715 | 98 | As is | 2.065 g |
| P-881633958 | 98 | As is | in stock |
| P-851265380 | 95 | As is | by synthesis |
| P-860799922 | 98 | As is | in stock |
| P-1263294838 | 95 | As is | in stock |
| P-579480899 | 95 | As is | in stock |
| P-505546806 | 95 | As is | in stock |
| P-588708710 | 98 | As is | unavailable |
| P-1273475833 | 95 | As is | in stock |
| P-854717600 | 95 | As is | in stock |
| P-474022528 | 95 | As is | in stock |
| P-608269693 | 98 | As is | in stock |
| P-579711261 | 98 | As is | in stock |
| P-892297062 | 95 | As is | unavailable |
| P-869162076 | 95 | As is | 228 mg |
| P-888657467 | 95 | As is | 203 mg |
| P-1271722589 | 98 | As is | in stock |
| P-867693275 | N/A | As a main component | in stock |
| P-875873373 | N/A | As a main component | in stock |
| P-874637265 | N/A | As a main component | by resynthesis (? - ? days) |
| P-1264449180 | 98 | As a main component | in stock |
| P-893605781 | 90 | As a main component | 8.826 g |
| P-891659873 | N/A | As a main component | by synthesis |
| P-895110246 | 99 | As a main component | 100 mg |
| P-1273263284 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1275490831 | 95 | As a main component | in stock |
| P-901897488 | 99 | As a main component | by synthesis |
| P-887189456 | 95 | As a main component | by synthesis |
| P-868658950 | 95 | As a main component | in stock |
| P-873250805 | 97 | As a main component | 5 mg |
| P-854719295 | 95 | As a main component | in stock |
| P-584617211 | 95 | As a main component | in stock |
| P-878644128 | 98 | As a main component | in stock |
| P-892288904 | 95 | As a main component | unavailable |
| P-869118715 | 95 | As a main component | 69 mg |
| P-888633744 | 95 | As a main component | 69 mg |
| P-1271598710 | 99 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 480.520 |
| logP | 0.7125 |
| H-bond acceptors | 12 |
| H-bond donors | 2 |
| Rotatable bonds | 9 |
| PSA | 142.01 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 135.4506 |
| Atoms | 63 |
| Rings | 5 |
| Heavy atoms | 35 |
| Hydrogen atoms | 28 |
| Heteroatoms | 12 |
| N/O atoms | 12 |
| 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 |
