MCULE-6021512202
- 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 | 33 USD | 95 | 7 working days | Get Quote |
| 5 mg | 56 USD | 98 | 16 working days | Get Quote |
| 10 mg | 86 USD | 98 | 16 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-6021512202.sdf |
| SMILES | MCULE-6021512202.smiles |
| Standard InChI | MCULE-6021512202.inchi |
| InChIKey | MCULE-6021512202.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867600478 | 98 | As is | in stock |
| P-867635840 | 95 | As is | in stock |
| P-901272884 | N/A | As is | in stock |
| P-875757941 | N/A | As is | in stock |
| P-869309092 | 95 | As is | in stock |
| P-903093288 | 98 | As is | 750 mg |
| P-903155646 | 98 | As is | 3 g |
| P-893618247 | 90 | As is | 5.904 g |
| P-597010219 | 98 | As is | 1000 mg |
| P-892190526 | 98 | As is | 2 g |
| P-881038509 | 95 | As is | in stock |
| P-901415638 | 95 | As is | by synthesis |
| P-861381724 | 95 | As is | by synthesis |
| P-500417757 | 98 | As is | in stock |
| P-870661395 | N/A | As is | in stock |
| P-870661399 | N/A | As is | in stock |
| P-505501058 | 95 | As is | in stock |
| P-900956350 | 95 | As is | in stock |
| P-596562824 | 97 | As is | 10 mg |
| P-873242271 | 97 | As is | 50 mg |
| P-896628308 | 95 | As is | by synthesis |
| P-854716008 | 95 | As is | in stock |
| P-474024833 | 95 | As is | in stock |
| P-878647169 | 98 | As is | in stock |
| P-1263958645 | 90 | As is | in stock |
| P-491318544 | 95 | As is | by synthesis |
| P-869126646 | 95 | As is | by synthesis |
| P-892291000 | 95 | As is | unavailable |
| P-888639977 | 95 | As is | 150 mg |
| P-906866078 | 98 | As is | by synthesis |
| P-906782431 | 99 | As is | by synthesis |
| P-906868962 | 98 | As is | by synthesis |
| P-855008179 | 90 | As is | in stock |
| P-868509650 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 218.251 |
| logP | 1.7402 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 49.41 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 67.5287 |
| Atoms | 30 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 14 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |

