Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6574674783-0
Structure
Show compound
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 | 95 | 14 working days | Get Quote |
| 5 mg | 7 USD | 95 | 14 working days | Get Quote |
| 10 mg | 7 USD | 95 | 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.
| Name | File |
|---|---|
| SDF | MCULE-6574674783-0.sdf |
| SMILES | MCULE-6574674783-0.smiles |
| Standard InChI | MCULE-6574674783-0.inchi |
| InChIKey | MCULE-6574674783-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867579138 | 95 | As is | in stock |
| P-875738669 | 95 | As is | in stock |
| P-595217927 | 95 | As is | by resynthesis (? - ? days) |
| P-903069263 | 95 | As is | 200 g |
| P-580216206 | 95 | As is | by synthesis |
| P-597007912 | 98 | As is | 200 g |
| P-552040223 | 95 | As is | by resynthesis (? - ? days) |
| P-864110280 | 95 | As is | in stock |
| P-901472021 | 95 | As is | by synthesis |
| P-619833323 | 90 | As is | 57 mg |
| P-887083468 | 95 | As is | in stock |
| P-580409226 | 95 | As is | by resynthesis (? - ? days) |
| P-861981351 | 98 | As is | 200 g |
| P-503209733 | 90 | As is | by synthesis |
| P-502872060 | 90 | As is | in stock |
| P-454389446 | 95 | As is | 69.578 g |
| P-18808788 | 95 | As is | 69.578 g |
| P-852453486 | 97 | As is | by synthesis |
| P-35193689 | 90 | As is | in stock |
| P-854762900 | 95 | As is | by synthesis |
| P-12467094 | 90 | As is | 87 mg |
| P-12459606 | 90 | As is | 173 mg |
| P-596760587 | 95 | As is | 120 g |
| P-502395571 | 90 | As is | in stock |
| P-22479704 | 90 | As is | 190 mg |
| P-1272896981 | 94 | As is | by resynthesis (? - ? days) |
| P-906869001 | 98 | As is | by synthesis |
| P-868506939 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 183.633 |
| logP | 2.6798 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 29.1 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 50.7307 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 10 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| 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 |
