MCULE-7274905630
- 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 | 95 | 12 working days | Get Quote |
| 5 mg | 116 USD | 95 | 12 working days | Get Quote |
| 10 mg | 181 USD | 95 | 12 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.
-
MCULE-9156023799
- Component type: Main
-
MCULE-2868939444
- Component type: Main
-
MCULE-4926623734
- Component type: Main
-
MCULE-4344525315
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7274905630.sdf |
| SMILES | MCULE-7274905630.smiles |
| Standard InChI | MCULE-7274905630.inchi |
| InChIKey | MCULE-7274905630.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1266019371 | 98 | As a main component | in stock |
| P-892877695 | 99 | As a main component | in stock |
| P-901256757 | 98 | As a main component | in stock |
| P-881627626 | N/A | As a main component | by synthesis |
| P-892192542 | 99 | As a main component | 200 mg |
| P-1274838442 | 95 | As a main component | by resynthesis (? - ? days) |
| P-905469394 | 95 | As a main component | in stock |
| P-591073943 | 99 | As a main component | by synthesis |
| P-901426616 | 95 | As a main component | by synthesis |
| P-901450102 | 95 | As a main component | by synthesis |
| P-580048491 | 90 | As a main component | by synthesis |
| P-1273109557 | 97 | As a main component | 100 mg |
| P-895184131 | 95 | As a main component | in stock |
| P-895184832 | 95 | As a main component | in stock |
| P-904224466 | 95 | As a main component | unavailable |
| P-1274333608 | 95 | As a main component | unavailable |
| P-904240302 | 95 | As a main component | unavailable |
| P-869127836 | 95 | As a main component | 994 mg |
| P-888640771 | 95 | As a main component | 990 mg |
| P-855066049 | 90 | As a main component | in stock |
| P-1271623206 | 99 | As a main component | in stock |
| P-886937840 | 98 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 280.363 |
| logP | 3.8206 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 48.02 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 89.2294 |
| Atoms | 41 |
| Rings | 3 |
| Heavy atoms | 21 |
| Hydrogen atoms | 20 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |

