MCULE-3823468718-0
- 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 | 14 USD | 98 | 20 working days | Get Quote |
| 5 mg | 14 USD | 98 | 20 working days | Get Quote |
| 10 mg | 14 USD | 98 | 20 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-3823468718-0.sdf |
| SMILES | MCULE-3823468718-0.smiles |
| Standard InChI | MCULE-3823468718-0.inchi |
| InChIKey | MCULE-3823468718-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867606567 | 97 | As is | in stock |
| P-875765087 | N/A | As is | in stock |
| P-590374848 | 95 | As is | in stock |
| P-903102352 | 98 | As is | 40 g |
| P-905490937 | 98 | As is | 10 g |
| P-893574824 | 90 | As is | 153.951 g |
| P-901165328 | 98 | As is | in stock |
| P-875894450 | N/A | As is | in stock |
| P-867715206 | N/A | As is | in stock |
| P-489126899 | 97 | As is | in stock |
| P-619196095 | 98 | As is | 30 g |
| P-589659321 | 95 | As is | by resynthesis (? - ? days) |
| P-869385029 | 95 | As is | in stock |
| P-862399920 | 98 | As is | 7 g |
| P-577168653 | 90 | As is | by synthesis |
| P-449270544 | 90 | As is | 21 mg |
| P-436443833 | 90 | As is | 9.434 g |
| P-339483 | 90 | As is | 452 mg |
| P-851282710 | 95 | As is | by synthesis |
| P-868602912 | 97 | As is | in stock |
| P-34729212 | 90 | As is | by synthesis |
| P-580788331 | 90 | As is | by resynthesis (? - ? days) |
| P-580278943 | 95 | As is | by resynthesis (? - ? days) |
| P-862024199 | 95 | As is | 153.411 g |
| P-905344509 | 95 | As is | 5 g |
| P-890212097 | 90 | As is | 1 mg |
| P-579523290 | 90 | As is | 1 mg |
| P-492220116 | 95 | As is | in stock |
| P-524175580 | 95 | As is | unavailable |
| P-870137633 | 95 | As is | 50 g |
| P-872929581 | N/A | As is | by synthesis |
| P-852387246 | N/A | As is | in stock |
| P-492286266 | 95 | As is | 1.138 g |
| P-13047199 | 90 | As is | 1.138 g |
| P-888869059 | N/A | As is | in stock |
| P-596796526 | 95 | As is | by synthesis |
| P-424823665 | 90 | As is | in stock |
| P-904093257 | 97 | As is | 411.38 g |
| P-33448510 | 90 | As is | in stock |
| P-502334496 | 90 | As is | in stock |
| P-611399868 | 90 | As is | in stock |
| P-25009813 | 90 | As is | 209 mg |
| P-3238611 | 90 | As is | 209 mg |
| P-615453819 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 194.183 |
| logP | 1.0849 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 55.76 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 48.8568 |
| Atoms | 24 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 10 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |

