Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6850175770
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 | 36 USD | 95 | 7 working days | Get Quote |
| 5 mg | 86 USD | 95 | 7 working days | Get Quote |
| 10 mg | 136 USD | 95 | 7 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-5620467726
- Component type: Main
-
1
MCULE-8295936189
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6850175770.sdf |
| SMILES | MCULE-6850175770.smiles |
| Standard InChI | MCULE-6850175770.inchi |
| InChIKey | MCULE-6850175770.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867543803 | 98 | As is | in stock |
| P-875701302 | N/A | As is | in stock |
| P-869332851 | 95 | As is | in stock |
| P-903025154 | 97 | As is | 500 mg |
| P-1264058157 | 95 | As is | in stock |
| P-893604978 | 90 | As is | 839 mg |
| P-881615913 | N/A | As is | in stock |
| P-900243177 | 97 | As is | 500 mg |
| P-872727734 | 98 | As is | in stock |
| P-889574492 | 95 | As is | in stock |
| P-890244522 | 97 | As is | 50 mg |
| P-1263255642 | 95 | As is | by synthesis |
| P-900266789 | 95 | As is | in stock |
| P-873248375 | 97 | As is | 10 mg |
| P-854720119 | 95 | As is | in stock |
| P-875882088 | 95 | As is | in stock |
| P-878644105 | 98 | As is | in stock |
| P-869109063 | 95 | As is | by synthesis |
| P-892287137 | 95 | As is | unavailable |
| P-888627822 | 95 | As is | 204 mg |
| P-611509399 | 90 | As is | in stock |
| P-893146015 | N/A | Main component | by synthesis |
| P-901182607 | N/A | Main component | by synthesis |
| P-903015692 | 95 | Main component | 50 mg |
| P-904321523 | 90 | Main component | 150 mg |
| P-905014119 | N/A | Main component | by synthesis |
| P-900243004 | 98 | Main component | 50 mg |
| P-905576859 | 97 | Main component | by synthesis |
| P-895195024 | 95 | Main component | by synthesis |
| P-892269506 | 95 | Main component | by synthesis |
| P-904252391 | 95 | Main component | unavailable |
| P-892347986 | 95 | Main component | 1.317 g |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 458.508 |
| logP | 4.169 |
| H-bond acceptors | 8 |
| H-bond donors | 3 |
| Rotatable bonds | 5 |
| PSA | 119.35 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 135.7659 |
| Atoms | 60 |
| Rings | 5 |
| Heavy atoms | 34 |
| Hydrogen atoms | 26 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
