Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5266397322
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 | 73 USD | 99 | 26 working days | Get Quote |
| 5 mg | 73 USD | 99 | 26 working days | Get Quote |
| 10 mg | 73 USD | 99 | 26 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.
-
1
MCULE-5728234189
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5266397322.sdf |
| SMILES | MCULE-5266397322.smiles |
| Standard InChI | MCULE-5266397322.inchi |
| InChIKey | MCULE-5266397322.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1263866120 | 90 | As is | 25 mg |
| P-1263082558 | N/A | As is | by synthesis |
| P-1273293012 | 95 | As is | by resynthesis (? - ? days) |
| P-904243790 | 95 | As is | unavailable |
| P-904211660 | 95 | As is | 31 mg |
| P-904228766 | 95 | As is | 31 mg |
| P-853435866 | 95 | Main component | by resynthesis (? - ? days) |
| P-851477411 | N/A | Main component | by synthesis |
| P-881618749 | N/A | Main component | by synthesis |
| P-454677308 | 90 | Main component | in stock |
| P-874589204 | 90 | Main component | 8 mg |
| P-519893643 | 90 | Main component | in stock |
| P-869107838 | 95 | Main component | unavailable |
| P-888626869 | 95 | Main component | unavailable |
| P-873212881 | 90 | Main component | in stock |
| P-872993379 | 90 | Main component | 47 mg |
| P-893617842 | 90 | Main component as a main component | 21.379 g |
| P-34677119 | 90 | Main component as a main component | by synthesis |
| P-901411627 | 99 | Main component as a main component | 15 g |
| P-505494022 | 95 | Main component as a main component | in stock |
| P-873244829 | 97 | Main component as a main component | 100 mg |
| P-502440590 | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 242.769 |
| logP | 2.6708 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 43.84 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 77.118 |
| Atoms | 30 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 15 |
| Heteroatoms | 4 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
