MCULE-3731847757
- 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 | 8 working days | Get Quote |
| 5 mg | 14 USD | 98 | 8 working days | Get Quote |
| 10 mg | 14 USD | 98 | 8 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-3731847757.sdf |
| SMILES | MCULE-3731847757.smiles |
| Standard InChI | MCULE-3731847757.inchi |
| InChIKey | MCULE-3731847757.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867557285 | 97 | As is | in stock |
| P-875716590 | N/A | As is | in stock |
| P-579760777 | 97 | As is | in stock |
| P-903044450 | 95 | As is | 150 g |
| P-1264051198 | 95 | As is | in stock |
| P-905489277 | 97 | As is | 10 g |
| P-851950587 | N/A | As is | in stock |
| P-865906738 | 98 | As is | 150 g |
| P-494426776 | 95 | As is | by resynthesis (? - ? days) |
| P-870063913 | 90 | As is | 1000 mg |
| P-864208429 | 95 | As is | in stock |
| P-481169792 | 95 | As is | 15.25 g |
| P-666963884 | 98 | As is | 36.25 g |
| P-454631808 | 90 | As is | in stock |
| P-449699923 | 90 | As is | 24.995 g |
| P-436441651 | 90 | As is | 47.827 g |
| P-77346 | 90 | As is | 1.056 g |
| P-436463288 | 95 | As is | 100 g |
| P-578527212 | 90 | As is | in stock |
| P-887104136 | 97 | As is | in stock |
| P-34742524 | 90 | As is | by synthesis |
| P-428629422 | 90 | As is | in stock |
| P-492273193 | 95 | As is | 12.515 g |
| P-861974278 | 95 | As is | 155.718 g |
| P-890219030 | 90 | As is | 5 g |
| P-590341479 | 90 | As is | 5 g |
| P-502447040 | 95 | As is | by synthesis |
| P-503008033 | 90 | As is | by synthesis |
| P-502618958 | 90 | As is | in stock |
| P-492224186 | 95 | As is | in stock |
| P-488555759 | 92 | As is | in stock |
| P-488546344 | 90 | As is | in stock |
| P-454300964 | 97 | As is | unavailable |
| P-454392760 | 97 | As is | unavailable |
| P-31144204 | 90 | As is | unavailable |
| P-14055323 | 95 | As is | 15 mg |
| P-601058234 | 90 | As is | 15 mg |
| P-588253074 | N/A | As is | by synthesis |
| P-852396561 | N/A | As is | in stock |
| P-428002242 | 90 | As is | 200 g |
| P-904060367 | 95 | As is | by synthesis |
| P-854717071 | 95 | As is | in stock |
| P-896072439 | 95 | As is | in stock |
| P-608274412 | 98 | As is | in stock |
| P-674953628 | 95 | As is | 12.515 g |
| P-454366162 | 92 | As is | in stock |
| P-13466297 | 92 | As is | 300 mg |
| P-856063423 | 95 | As is | in stock |
| P-18856756 | 90 | As is | in stock |
| P-464621740 | 95 | As is | by synthesis |
| P-892286335 | 95 | As is | unavailable |
| P-888626775 | 95 | As is | 202 mg |
| P-33483975 | 90 | As is | in stock |
| P-502336384 | 90 | As is | in stock |
| P-888371519 | 94 | As is | by resynthesis (? - ? days) |
| P-875266817 | 90 | As is | 5 mg |
| P-906784595 | 98 | As is | by synthesis |
| P-611384274 | 90 | As is | in stock |
| P-1039386 | 90 | As is | 1.296 g |
| P-2908698 | 90 | As is | 110 mg |
| P-3220607 | 90 | As is | 1.296 g |
| P-872754628 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 190.198 |
| logP | 1.5801 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 65.98 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 52.4455 |
| 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 |

