Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3473512955-0
Structure
Show compound
In order to add this molecule to a collection you have to create an account.
Sign up for free
- 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 | 7 USD | 98 | 14 working days | Get Quote |
| 5 mg | 13 USD | 98 | 11 working days | Get Quote |
| 10 mg | 13 USD | 98 | 11 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.
-
1
MCULE-6828532641-0
- Component type: Main
-
1
MCULE-1176533515-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3473512955-0.sdf |
| SMILES | MCULE-3473512955-0.smiles |
| Standard InChI | MCULE-3473512955-0.inchi |
| InChIKey | MCULE-3473512955-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-862014636 | 98 | As is | 200 g |
| P-867567136 | 98 | Main component | in stock |
| P-875726822 | 98 | Main component | in stock |
| P-1275181212 | 99 | Main component | in stock |
| P-1275191469 | 98 | Main component | in stock |
| P-580193535 | 98 | Main component | in stock |
| P-903055913 | 98 | Main component | 10 g |
| P-1264046961 | 95 | Main component | in stock |
| P-893575331 | 90 | Main component | 10.952 kg |
| P-1270328869 | 98 | Main component | in stock |
| P-617049410 | 95 | Main component | by resynthesis (? - ? days) |
| P-606886948 | N/A | Main component | in stock |
| P-596947681 | 98 | Main component | 10 g |
| P-1273453720 | 95 | Main component | by resynthesis (? - ? days) |
| P-1273473384 | 95 | Main component | by resynthesis (? - ? days) |
| P-864104484 | 95 | Main component | in stock |
| P-900154766 | 99 | Main component | in stock |
| P-868543859 | 99 | Main component | in stock |
| P-873435973 | 98 | Main component | 5.2 g |
| P-871220053 | N/A | Main component | by resynthesis (? - ? days) |
| P-893267203 | 95 | Main component | by synthesis |
| P-893219301 | 95 | Main component | in stock |
| P-893232964 | 95 | Main component | in stock |
| P-505578095 | 98 | Main component | in stock |
| P-1272268016 | 90 | Main component | 984 mg |
| P-881634030 | 98 | Main component | in stock |
| P-851239616 | 95 | Main component | by synthesis |
| P-860797881 | 98 | Main component | in stock |
| P-868595967 | 98 | Main component | in stock |
| P-579478565 | 95 | Main component | in stock |
| P-896534287 | 95 | Main component | 1000 mg |
| P-861987731 | 95 | Main component | 10 g |
| P-608220672 | 99 | Main component | in stock |
| P-505515671 | 95 | Main component | in stock |
| P-856009143 | 95 | Main component | 1.005 g |
| P-579617220 | 98 | Main component | in stock |
| P-1272581738 | 95 | Main component | 20 g |
| P-852444489 | 95 | Main component | by synthesis |
| P-854714933 | 95 | Main component | in stock |
| P-1268711069 | 95 | Main component | in stock |
| P-474025260 | 95 | Main component | in stock |
| P-608276402 | 98 | Main component | in stock |
| P-500410206 | 98 | Main component | by synthesis |
| P-1263957902 | 90 | Main component | in stock |
| P-889868064 | 95 | Main component | by synthesis |
| P-579709811 | 98 | Main component | in stock |
| P-869119012 | 95 | Main component | 359 mg |
| P-892289023 | 95 | Main component | 359 mg |
| P-888633992 | 95 | Main component | 359 mg |
| P-611429841 | 90 | Main component | in stock |
| P-855029346 | 90 | Main component | in stock |
| P-855029347 | 90 | Main component | in stock |
| P-893943868 | 98 | Main component | in stock |
| P-892867123 | N/A | Main component as a main component | in stock |
| P-890162865 | N/A | Main component as a main component | in stock |
| P-853429647 | 98 | Main component as a main component | by resynthesis (? - ? days) |
| P-893457566 | 90 | Main component as a main component | 500 mg |
| P-1270295568 | 98 | Main component as a main component | in stock |
| P-851467116 | N/A | Main component as a main component | by synthesis |
| P-489177949 | 97 | Main component as a main component | in stock |
| P-873296656 | N/A | Main component as a main component | 300 mg |
| P-1273266966 | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-905469360 | 95 | Main component as a main component | in stock |
| P-868545567 | 99 | Main component as a main component | in stock |
| P-590785410 | 98 | Main component as a main component | by synthesis |
| P-901562255 | 95 | Main component as a main component | by synthesis |
| P-893219302 | 95 | Main component as a main component | in stock |
| P-893234947 | 95 | Main component as a main component | in stock |
| P-851250092 | 95 | Main component as a main component | by synthesis |
| P-851250072 | 95 | Main component as a main component | by synthesis |
| P-1266981779 | 95 | Main component as a main component | by synthesis |
| P-852523332 | 95 | Main component as a main component | by synthesis |
| P-852523343 | 95 | Main component as a main component | by synthesis |
| P-1275010448 | 95 | Main component as a main component | in stock |
| P-896072177 | 95 | Main component as a main component | in stock |
| P-617402665 | 98 | Main component as a main component | in stock |
| P-892291403 | 95 | Main component as a main component | unavailable |
| P-869127229 | 95 | Main component as a main component | 77 mg |
| P-888640389 | 95 | Main component as a main component | 70 mg |
| P-893982484 | 99 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 701.719 |
| logP | 8.8243 |
| H-bond acceptors | 11 |
| H-bond donors | 3 |
| Rotatable bonds | 9 |
| PSA | 160.37 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 182.3437 |
| Atoms | 80 |
| Rings | 6 |
| Heavy atoms | 50 |
| Hydrogen atoms | 30 |
| Heteroatoms | 15 |
| N/O atoms | 11 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
