Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3054384715
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 | 30 USD | 95 | 7 working days | Get Quote |
| 5 mg | 49 USD | 98 | 16 working days | Get Quote |
| 10 mg | 75 USD | 98 | 16 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.
| Name | File |
|---|---|
| SDF | MCULE-3054384715.sdf |
| SMILES | MCULE-3054384715.smiles |
| Standard InChI | MCULE-3054384715.inchi |
| InChIKey | MCULE-3054384715.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867548071 | N/A | As is | in stock |
| P-875705185 | 98 | As is | in stock |
| P-869209269 | 95 | As is | by resynthesis (? - ? days) |
| P-903030326 | 99 | As is | 300 mg |
| P-1264052806 | 99 | As is | in stock |
| P-610952939 | 90 | As is | 3.065 g |
| P-1270328368 | 98 | As is | in stock |
| P-888934176 | N/A | As is | in stock |
| P-888813914 | 99 | As is | 300 mg |
| P-1273268977 | 95 | As is | by resynthesis (? - ? days) |
| P-590819911 | 98 | As is | by synthesis |
| P-901448314 | 95 | As is | by synthesis |
| P-851297280 | 95 | As is | by synthesis |
| P-860799960 | 98 | As is | in stock |
| P-887198605 | 95 | As is | by synthesis |
| P-579480996 | 95 | As is | in stock |
| P-868079246 | 95 | As is | in stock |
| P-873250926 | 97 | As is | 5 mg |
| P-854715774 | 95 | As is | in stock |
| P-474021385 | 95 | As is | in stock |
| P-878641279 | 98 | As is | in stock |
| P-579713004 | 98 | As is | in stock |
| P-851358190 | 98 | As is | 0 mg |
| P-892293482 | 95 | As is | unavailable |
| P-869154322 | 95 | As is | 101 mg |
| P-888652028 | 95 | As is | 101 mg |
| P-611432581 | 90 | As is | in stock |
| P-611491981 | 90 | As is | in stock |
| P-1271558842 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 561.502 |
| logP | 6.5042 |
| H-bond acceptors | 8 |
| H-bond donors | 2 |
| Rotatable bonds | 11 |
| PSA | 89.78 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 135.9199 |
| Atoms | 64 |
| Rings | 5 |
| Heavy atoms | 40 |
| Hydrogen atoms | 24 |
| Heteroatoms | 13 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 5 |
| 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 |
