MCULE-3513426062
- 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 | 6 USD | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 USD | 98 | 14 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-3513426062.sdf |
| SMILES | MCULE-3513426062.smiles |
| Standard InChI | MCULE-3513426062.inchi |
| InChIKey | MCULE-3513426062.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867555259 | 97 | As is | in stock |
| P-875714055 | 97 | As is | in stock |
| P-1275156326 | 95 | As is | in stock |
| P-1275193761 | 98 | As is | in stock |
| P-903041149 | 98 | As is | 1.5 kg |
| P-905479533 | 98 | As is | 100 g |
| P-1270395963 | 98 | As is | in stock |
| P-580200280 | 95 | As is | 10 g |
| P-606948584 | N/A | As is | in stock |
| P-489121358 | 97 | As is | in stock |
| P-596943130 | 97 | As is | 1.5 kg |
| P-895957133 | 95 | As is | 5 g |
| P-869992689 | 90 | As is | 1000 mg |
| P-864089149 | 95 | As is | in stock |
| P-580698724 | 98 | As is | 661 g |
| P-492248594 | 95 | As is | in stock |
| P-454633015 | 90 | As is | in stock |
| P-448677979 | 90 | As is | 275.095 g |
| P-436452422 | 95 | As is | in stock |
| P-425206491 | 90 | As is | in stock |
| P-851284187 | 95 | As is | by synthesis |
| P-868578746 | 98 | As is | in stock |
| P-34771066 | 90 | As is | by synthesis |
| P-580279667 | 95 | As is | by resynthesis (? - ? days) |
| P-905332783 | 97 | As is | 95 g |
| P-901368682 | 97 | As is | 19 g |
| P-861962722 | 97 | As is | 2.75302 kg |
| P-588281456 | 98 | As is | in stock |
| P-870657679 | N/A | As is | in stock |
| P-505523257 | 95 | As is | in stock |
| P-502459286 | 95 | As is | by synthesis |
| P-492225813 | 95 | As is | in stock |
| P-502722140 | 90 | As is | in stock |
| P-488543079 | 90 | As is | in stock |
| P-12380276 | 92 | As is | 300 mg |
| P-454415925 | 97 | As is | 3.88 g |
| P-454349066 | 97 | As is | 3.88 g |
| P-31143455 | 90 | As is | unavailable |
| P-905454271 | 95 | As is | by synthesis |
| P-580512114 | N/A | As is | in stock |
| P-1272566725 | N/A | As is | 100 g |
| P-852387243 | N/A | As is | by synthesis |
| P-854740921 | 95 | As is | in stock |
| P-492286233 | 95 | As is | 5.7 g |
| P-26557381 | 90 | As is | 5.7 g |
| P-454363887 | 92 | As is | in stock |
| P-13347019 | 92 | As is | 300 mg |
| P-500399478 | 97 | As is | by synthesis |
| P-885517848 | 95 | As is | by synthesis |
| P-18844329 | 90 | As is | in stock |
| P-596778333 | 97 | As is | 1.4446 kg |
| P-22781629 | 90 | As is | in stock |
| P-502333849 | 90 | As is | in stock |
| P-888359753 | 94 | As is | by resynthesis (? - ? days) |
| P-906763813 | 98 | As is | by synthesis |
| P-855241677 | 90 | As is | in stock |
| P-3227423 | 90 | As is | 1.649 g |
| P-3247137 | 90 | As is | 120 mg |
| P-424662962 | 90 | As is | 120 mg |
| P-1271645643 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 159.184 |
| logP | 1.9908 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 22.0 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 48.5875 |
| Atoms | 21 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 9 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |

