Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9892421890-0
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 | 97 | 22 working days | Get Quote |
| 5 mg | 6 USD | 97 | 22 working days | Get Quote |
| 10 mg | 6 USD | 97 | 22 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.
-
MCULE-4737953293-0
- Component type: Main
-
MCULE-3107139098-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9892421890-0.sdf |
| SMILES | MCULE-9892421890-0.smiles |
| Standard InChI | MCULE-9892421890-0.inchi |
| InChIKey | MCULE-9892421890-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867575976 | 97 | As is | in stock |
| P-875736223 | N/A | As is | in stock |
| P-590379084 | 97 | As is | in stock |
| P-903066049 | 98 | As is | 600 g |
| P-606848628 | N/A | As is | in stock |
| P-596951083 | 98 | As is | 200 g |
| P-872723612 | 98 | As is | in stock |
| P-864196629 | 95 | As is | in stock |
| P-580698550 | 97 | As is | 135 g |
| P-868615588 | 97 | As is | in stock |
| P-580302460 | 95 | As is | by resynthesis (? - ? days) |
| P-608220167 | 98 | As is | in stock |
| P-870647434 | N/A | As is | in stock |
| P-492243120 | 95 | As is | in stock |
| P-488550316 | 90 | As is | in stock |
| P-13771712 | 95 | As is | 300 mg |
| P-856009507 | 97 | As is | 100 mg |
| P-524163806 | 98 | As is | 25 g |
| P-31164816 | 90 | As is | 2 g |
| P-856040657 | 90 | As is | 2 g |
| P-852466145 | N/A | As is | in stock |
| P-854694036 | 95 | As is | in stock |
| P-474022423 | 95 | As is | in stock |
| P-888171777 | 98 | As is | by synthesis |
| P-12736664 | 90 | As is | 1000 mg |
| P-620226245 | 95 | As is | 1000 mg |
| P-454368621 | 92 | As is | in stock |
| P-864669345 | 92 | As is | 300 mg |
| P-885528642 | 95 | As is | by synthesis |
| P-23969306 | 90 | As is | in stock |
| P-617402607 | N/A | As is | in stock |
| P-464642607 | 95 | As is | by synthesis |
| P-869176294 | 95 | As is | in stock |
| P-892292834 | 95 | As is | 504 mg |
| P-892327884 | 95 | As is | 504 mg |
| P-33162891 | 90 | As is | 1000 mg |
| P-906776221 | 97 | As is | by synthesis |
| P-611511029 | 90 | As is | in stock |
| P-2377809 | 90 | As is | 1.011 g |
| P-464681704 | 90 | As is | 1.011 g |
| P-615410436 | 95 | As is | in stock |
| P-892864478 | 98 | As a main component | in stock |
| P-890158680 | N/A | As a main component | in stock |
| P-903154967 | 98 | As a main component | 3 kg |
| P-892190529 | 98 | As a main component | 2.5 kg |
| P-454413221 | 97 | As a main component | 5 g |
| P-885550533 | 95 | As a main component | by synthesis |
| P-33266792 | 90 | As a main component | in stock |
| P-906789325 | 98 | As a main component | by synthesis |
| P-894007460 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 175.186 |
| logP | 0.6383 |
| H-bond acceptors | 6 |
| H-bond donors | 4 |
| Rotatable bonds | 6 |
| PSA | 118.44 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 41.5333 |
| Atoms | 25 |
| Rings | 0 |
| Heavy atoms | 12 |
| Hydrogen atoms | 13 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
