MCULE-6271583991-0
- 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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 29 USD | 92 | 18 working days | Get Quote |
| 10 mg | 36 USD | 92 | 18 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-6271583991-0.sdf |
| SMILES | MCULE-6271583991-0.smiles |
| Standard InChI | MCULE-6271583991-0.inchi |
| InChIKey | MCULE-6271583991-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-852098557 | 95 | As is | by synthesis |
| P-901271333 | N/A | As is | in stock |
| P-615730391 | 95 | As is | in stock |
| P-851748657 | N/A | As is | by synthesis |
| P-901357748 | 95 | As is | by synthesis |
| P-590937331 | 95 | As is | by synthesis |
| P-4224421 | 90 | As is | 5 mg |
| P-454711042 | 90 | As is | in stock |
| P-436459333 | 95 | As is | 4 g |
| P-675061582 | 90 | As is | in stock |
| P-868632317 | 95 | As is | in stock |
| P-34834682 | 90 | As is | in stock |
| P-502543850 | 95 | As is | by synthesis |
| P-502759760 | 90 | As is | in stock |
| P-492220942 | 95 | As is | in stock |
| P-488545925 | 90 | As is | in stock |
| P-617902556 | 92 | As is | 234 mg |
| P-596587233 | 90 | As is | 5 g |
| P-852431206 | N/A | As is | in stock |
| P-854921232 | 95 | As is | by synthesis |
| P-641787830 | 90 | As is | by synthesis |
| P-454365969 | 92 | As is | in stock |
| P-674433933 | 92 | As is | 234 mg |
| P-885517604 | 95 | As is | by synthesis |
| P-18831214 | 90 | As is | in stock |
| P-22656828 | 90 | As is | in stock |
| P-502329933 | 90 | As is | in stock |
| P-903955801 | 94 | As is | by resynthesis (? - ? days) |
| P-855229678 | 90 | As is | in stock |
| P-25008524 | 90 | As is | 2.029 g |
| P-3225320 | 90 | As is | 2.029 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 271.267 |
| logP | 2.7187 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 75.63 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 74.1075 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 13 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |

