Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6750415233-0
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 | 6 USD | 99 | 20 working days | Get Quote |
| 5 mg | 6 USD | 99 | 20 working days | Get Quote |
| 10 mg | 6 USD | 99 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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-5108293188-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6750415233-0.sdf |
| SMILES | MCULE-6750415233-0.smiles |
| Standard InChI | MCULE-6750415233-0.inchi |
| InChIKey | MCULE-6750415233-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-893165582 | N/A | As is | by synthesis |
| P-904563371 | 95 | As is | in stock |
| P-590736777 | 95 | As is | by synthesis |
| P-895521897 | 95 | As is | by synthesis |
| P-867577213 | 98 | Main component | in stock |
| P-875737473 | N/A | Main component | in stock |
| P-505354467 | 98 | Main component | in stock |
| P-535624666 | 99 | Main component | in stock |
| P-881670183 | 95 | Main component | in stock |
| P-903067514 | 99 | Main component | 4.5 kg |
| P-901164376 | 98 | Main component | in stock |
| P-580269181 | 95 | Main component | by synthesis |
| P-851931730 | N/A | Main component | in stock |
| P-489191947 | 97 | Main component | in stock |
| P-596951574 | 99 | Main component | 250 kg |
| P-864187505 | 98 | Main component | in stock |
| P-893233762 | 95 | Main component | in stock |
| P-448677918 | 90 | Main component | 9 mg |
| P-851280681 | 95 | Main component | by synthesis |
| P-868576599 | 98 | Main component | in stock |
| P-580427428 | 95 | Main component | by resynthesis (? - ? days) |
| P-861960891 | 95 | Main component | 10 kg |
| P-889112562 | 95 | Main component | 10 kg |
| P-503625139 | 90 | Main component | by synthesis |
| P-492242849 | 95 | Main component | in stock |
| P-488550597 | 90 | Main component | in stock |
| P-596602695 | 95 | Main component | 25 g |
| P-31248395 | 90 | Main component | unavailable |
| P-856042404 | 90 | Main component | unavailable |
| P-613284580 | 95 | Main component | by synthesis |
| P-852443533 | N/A | Main component | in stock |
| P-854726176 | 95 | Main component | in stock |
| P-12412011 | 90 | Main component | 512 mg |
| P-617687971 | 95 | Main component | 512 mg |
| P-454368922 | 92 | Main component | in stock |
| P-889862410 | 95 | Main component | by synthesis |
| P-519807845 | 90 | Main component | in stock |
| P-896081304 | N/A | Main component | 93.974 g |
| P-502331798 | 90 | Main component | in stock |
| P-855012906 | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 188.610 |
| logP | 3.3918 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 71.84 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 51.5994 |
| Atoms | 21 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 9 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |
