MCULE-2825367435-0
- 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 | 50 USD | 90 | 21 working days | Get Quote |
| 5 mg | 77 USD | 90 | 21 working days | Get Quote |
| 10 mg | 88 USD | 97 | 15 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-2825367435-0.sdf |
| SMILES | MCULE-2825367435-0.smiles |
| Standard InChI | MCULE-2825367435-0.inchi |
| InChIKey | MCULE-2825367435-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886637233 | 95 | As is | in stock |
| P-901277983 | N/A | As is | in stock |
| P-615712869 | 95 | As is | in stock |
| P-903182390 | 95 | As is | 500 mg |
| P-893616457 | 90 | As is | 17.197 g |
| P-896060430 | N/A | As is | in stock |
| P-596264233 | 90 | As is | 1000 mg |
| P-596486140 | 90 | As is | 1000 mg |
| P-905465128 | 95 | As is | in stock |
| P-901919819 | 97 | As is | 3.7 g |
| P-901503089 | 95 | As is | by synthesis |
| P-577140176 | 90 | As is | by synthesis |
| P-868569925 | 98 | As is | in stock |
| P-862108700 | 95 | As is | 8.85 g |
| P-579511839 | 90 | As is | 1000 mg |
| P-890209496 | 90 | As is | in stock |
| P-502530638 | 95 | As is | by synthesis |
| P-504272933 | 90 | As is | by synthesis |
| P-502798673 | 90 | As is | in stock |
| P-524173549 | 95 | As is | unavailable |
| P-14063819 | 95 | As is | 473 mg |
| P-601060602 | 90 | As is | 473 mg |
| P-852402827 | N/A | As is | in stock |
| P-895267933 | 95 | As is | by synthesis |
| P-13039571 | 90 | As is | 50 mg |
| P-904097716 | 97 | As is | 17.98 g |
| P-502334946 | 90 | As is | in stock |
| P-903659469 | 94 | As is | by resynthesis (? - ? days) |
| P-906806091 | 97 | As is | by synthesis |
| P-611606268 | 90 | As is | in stock |
| P-893778211 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 221.188 |
| logP | 1.413 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 68.01 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 53.2423 |
| Atoms | 24 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 8 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |

