Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6568763839
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 | 6 USD | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 USD | 98 | 14 working days | Get Quote |
- 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-6568763839.sdf |
| SMILES | MCULE-6568763839.smiles |
| Standard InChI | MCULE-6568763839.inchi |
| InChIKey | MCULE-6568763839.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867581239 | 98 | As is | in stock |
| P-875739920 | 98 | As is | in stock |
| P-1275172187 | 98 | As is | in stock |
| P-903070343 | 98 | As is | 200 g |
| P-893549911 | 90 | As is | 3.24728 kg |
| P-1270337182 | 98 | As is | in stock |
| P-851929953 | N/A | As is | in stock |
| P-596983699 | 97 | As is | 200 g |
| P-494320794 | 95 | As is | 45 g |
| P-864124224 | 97 | As is | in stock |
| P-617430907 | 98 | As is | 195 g |
| P-454639338 | 90 | As is | in stock |
| P-868613303 | 98 | As is | in stock |
| P-905328789 | 98 | As is | 165 g |
| P-861923990 | 98 | As is | 2.07328 kg |
| P-870661068 | N/A | As is | in stock |
| P-579474699 | 95 | As is | 100 mg |
| P-856021278 | 90 | As is | 1000 mg |
| P-1272588288 | 98 | As is | 100 g |
| P-852466139 | 98 | As is | by synthesis |
| P-854757651 | 95 | As is | in stock |
| P-885547881 | 95 | As is | by synthesis |
| P-502406922 | 90 | As is | in stock |
| P-906775102 | 98 | As is | by synthesis |
| P-855314769 | 90 | As is | in stock |
| P-1271669682 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 246.208 |
| logP | 3.0304 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 34.14 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 61.461 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 8 |
| Heteroatoms | 4 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
