Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2118304118
Compound
Show structure
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 | 10 USD | 98 | 22 working days | Get Quote |
| 5 mg | 10 USD | 98 | 22 working days | Get Quote |
| 10 mg | 10 USD | 98 | 22 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-2118304118.sdf |
| SMILES | MCULE-2118304118.smiles |
| Standard InChI | MCULE-2118304118.inchi |
| InChIKey | MCULE-2118304118.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867553084 | 98 | As is | in stock |
| P-1266115560 | 95 | As is | in stock |
| P-875711298 | 98 | As is | in stock |
| P-1265844158 | 95 | As is | in stock |
| P-597013848 | 95 | As is | unavailable |
| P-1275173230 | 97 | As is | in stock |
| P-1275147506 | 95 | As is | in stock |
| P-903037498 | 95 | As is | 5 g |
| P-1264586660 | N/A | As is | 200 g |
| P-905486987 | 95 | As is | 1000 g |
| P-1270373079 | N/A | As is | in stock |
| P-580256228 | 95 | As is | by synthesis |
| P-617056206 | 95 | As is | by resynthesis (? - ? days) |
| P-606909720 | N/A | As is | in stock |
| P-489116878 | 97 | As is | in stock |
| P-596942203 | 98 | As is | unavailable |
| P-1271963872 | 96 | As is | 200 g |
| P-1273282121 | 95 | As is | by resynthesis (? - ? days) |
| P-895944363 | 95 | As is | by resynthesis (? - ? days) |
| P-864126178 | 95 | As is | in stock |
| P-481174820 | 95 | As is | 4.429 kg |
| P-580726039 | 95 | As is | 511 g |
| P-893251371 | 95 | As is | by synthesis |
| P-608405137 | 90 | As is | in stock |
| P-436480601 | 95 | As is | in stock |
| P-851287274 | 95 | As is | by synthesis |
| P-868604658 | 95 | As is | in stock |
| P-580376154 | N/A | As is | by resynthesis (? - ? days) |
| P-580433634 | 95 | As is | by resynthesis (? - ? days) |
| P-500252641 | N/A | As is | in stock |
| P-579718127 | 95 | As is | in stock |
| P-905334902 | N/A | As is | 284 g |
| P-861988518 | N/A | As is | 12.2641 kg |
| P-505540386 | 95 | As is | in stock |
| P-524182561 | 95 | As is | 5 g |
| P-855995772 | 95 | As is | 100 mg |
| P-579627345 | 95 | As is | in stock |
| P-888159637 | 95 | As is | by synthesis |
| P-581744692 | 94 | As is | in stock |
| P-1272584082 | 96 | As is | 2 kg |
| P-852454136 | 96 | As is | by synthesis |
| P-854739511 | 95 | As is | in stock |
| P-888902060 | N/A | As is | in stock |
| P-885543596 | 95 | As is | by synthesis |
| P-502373313 | 90 | As is | in stock |
| P-906897769 | 95 | As is | by synthesis |
| P-906879652 | 85 | As is | by synthesis |
| P-590431852 | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 209.081 |
| logP | 1.9245 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 18.46 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 43.689 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 13 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
