Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7796843804
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 | 17 USD | 97 | 20 working days | Get Quote |
| 5 mg | 17 USD | 97 | 20 working days | Get Quote |
| 10 mg | 17 USD | 97 | 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-7796843804.sdf |
| SMILES | MCULE-7796843804.smiles |
| Standard InChI | MCULE-7796843804.inchi |
| InChIKey | MCULE-7796843804.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-674976829 | 97 | As is | by synthesis |
| P-890144954 | N/A | As is | in stock |
| P-579760164 | 98 | As is | in stock |
| P-615725318 | 98 | As is | in stock |
| P-903068695 | 97 | As is | 50 g |
| P-606937441 | N/A | As is | in stock |
| P-489134348 | 97 | As is | in stock |
| P-597005839 | 97 | As is | 50 g |
| P-494328420 | 95 | As is | by resynthesis (? - ? days) |
| P-596295312 | 90 | As is | 153 mg |
| P-596487322 | 90 | As is | 153 mg |
| P-864085932 | 97 | As is | in stock |
| P-904367721 | 97 | As is | 38.14 g |
| P-4255991 | 90 | As is | 100 mg |
| P-454631149 | 90 | As is | in stock |
| P-24543 | 90 | As is | 8 mg |
| P-436452402 | 95 | As is | 150 g |
| P-425216551 | 90 | As is | in stock |
| P-34892679 | 90 | As is | in stock |
| P-851273945 | 95 | As is | by synthesis |
| P-868645938 | 98 | As is | in stock |
| P-34744400 | 90 | As is | by synthesis |
| P-580272709 | 95 | As is | by resynthesis (? - ? days) |
| P-888313027 | N/A | As is | in stock |
| P-505542107 | 95 | As is | in stock |
| P-503134014 | 90 | As is | by synthesis |
| P-502618956 | 90 | As is | in stock |
| P-675514186 | 95 | As is | in stock |
| P-12377855 | 95 | As is | 300 mg |
| P-579476168 | 90 | As is | unavailable |
| P-500223250 | 96 | As is | in stock |
| P-613150525 | 90 | As is | 429 mg |
| P-852406474 | N/A | As is | in stock |
| P-35221395 | 90 | As is | 3.828 kg |
| P-854908463 | 95 | As is | by synthesis |
| P-424128825 | 90 | As is | 100 mg |
| P-500398613 | 98 | As is | by synthesis |
| P-19310177 | 90 | As is | in stock |
| P-502358680 | 90 | As is | in stock |
| P-22452579 | 90 | As is | 78 mg |
| P-906902798 | 97 | As is | in stock |
| P-906767938 | 99 | As is | by synthesis |
| P-1411514 | 90 | As is | 1.31 g |
| P-575329638 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 209.241 |
| logP | 2.0108 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 59.16 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 57.0057 |
| Atoms | 30 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 15 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
