Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6823978511-0
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 | 12 USD | 98 | 22 working days | Get Quote |
| 5 mg | 20 USD | 98 | 20 working days | Get Quote |
| 10 mg | 32 USD | 98 | 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.
| Name | File |
|---|---|
| SDF | MCULE-6823978511-0.sdf |
| SMILES | MCULE-6823978511-0.smiles |
| Standard InChI | MCULE-6823978511-0.inchi |
| InChIKey | MCULE-6823978511-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867643918 | 98 | As is | in stock |
| P-875810846 | N/A | As is | in stock |
| P-590359820 | 98 | As is | in stock |
| P-903170478 | 98 | As is | 1000 mg |
| P-1264047475 | 95 | As is | in stock |
| P-893509325 | 90 | As is | 5.26 g |
| P-606909185 | N/A | As is | in stock |
| P-489240856 | 97 | As is | in stock |
| P-596969615 | 98 | As is | 125 mg |
| P-580192444 | 98 | As is | in stock |
| P-889553844 | 95 | As is | in stock |
| P-584629682 | 98 | As is | 439 mg |
| P-851249189 | 95 | As is | by synthesis |
| P-861381181 | 95 | As is | by synthesis |
| P-579478933 | 95 | As is | in stock |
| P-675214900 | 95 | As is | in stock |
| P-524439808 | 97 | As is | 35 mg |
| P-852522990 | N/A | As is | in stock |
| P-904640960 | 95 | As is | by synthesis |
| P-854717218 | 95 | As is | in stock |
| P-474020844 | 95 | As is | in stock |
| P-608276483 | 98 | As is | in stock |
| P-579712198 | N/A | As is | in stock |
| P-873285355 | N/A | As is | in stock |
| P-869162124 | 95 | As is | by synthesis |
| P-892297129 | 95 | As is | unavailable |
| P-888657514 | 95 | As is | 152 mg |
| P-480841139 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 430.405 |
| logP | 5.5958 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 105.24 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 106.4767 |
| Atoms | 43 |
| Rings | 4 |
| Heavy atoms | 30 |
| Hydrogen atoms | 13 |
| Heteroatoms | 10 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
