Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7836068095
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 | 28 USD | 97 | 15 working days | Get Quote |
| 5 mg | 70 USD | 95 | 7 working days | Get Quote |
| 10 mg | 125 USD | 95 | 7 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-3548959856
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7836068095.sdf |
| SMILES | MCULE-7836068095.smiles |
| Standard InChI | MCULE-7836068095.inchi |
| InChIKey | MCULE-7836068095.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1275578098 | 98 | As is | by synthesis |
| P-1274582840 | 95 | As is | in stock |
| P-869109712 | 95 | As is | unavailable |
| P-888628239 | 95 | As is | unavailable |
| P-867564766 | 97 | Main component | in stock |
| P-875724352 | 97 | Main component | in stock |
| P-869321185 | 95 | Main component | by resynthesis (? - ? days) |
| P-903053753 | 97 | Main component | 70 mg |
| P-893584607 | 90 | Main component | 391 mg |
| P-1270345502 | 97 | Main component | in stock |
| P-675220971 | 95 | Main component | by resynthesis (? - ? days) |
| P-888731702 | N/A | Main component | in stock |
| P-596928791 | 97 | Main component | 70 mg |
| P-1273450476 | 95 | Main component | by resynthesis (? - ? days) |
| P-864152334 | 95 | Main component | in stock |
| P-892414385 | 97 | Main component | 19 mg |
| P-861512698 | 95 | Main component | by synthesis |
| P-900266228 | 95 | Main component | in stock |
| P-901407753 | 97 | Main component | 70 mg |
| P-596582486 | 97 | Main component | 100 mg |
| P-854719269 | 95 | Main component | in stock |
| P-878643267 | 98 | Main component | in stock |
| P-892287346 | 95 | Main component | unavailable |
| P-869109711 | 95 | Main component | 96 mg |
| P-888628238 | 95 | Main component | 96 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 354.252 |
| logP | 3.1206 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 88.17 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 94.1794 |
| Atoms | 38 |
| Rings | 2 |
| Heavy atoms | 21 |
| Hydrogen atoms | 17 |
| Heteroatoms | 9 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
