Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2293408682
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 | 48 USD | 90 | 22 working days | Get Quote |
| 5 mg | 70 USD | 90 | 22 working days | Get Quote |
| 10 mg | 88 USD | 90 | 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-2293408682.sdf |
| SMILES | MCULE-2293408682.smiles |
| Standard InChI | MCULE-2293408682.inchi |
| InChIKey | MCULE-2293408682.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1266343959 | 98 | As is | in stock |
| P-1265984007 | 98 | As is | in stock |
| P-893276810 | 98 | As is | by resynthesis (? - ? days) |
| P-1264845596 | 98 | As is | 3 g |
| P-893448060 | 90 | As is | 14.82 g |
| P-1272052336 | 98 | As is | 3 g |
| P-1273445137 | 95 | As is | by resynthesis (? - ? days) |
| P-905465828 | 95 | As is | in stock |
| P-3619627 | 90 | As is | 50 mg |
| P-674217640 | 90 | As is | 15 mg |
| P-19936708 | 90 | As is | in stock |
| P-889037512 | 95 | As is | by synthesis |
| P-34610060 | 90 | As is | by synthesis |
| P-905410866 | 98 | As is | 8.82 g |
| P-895228013 | 95 | As is | in stock |
| P-654862775 | 90 | As is | by synthesis |
| P-23960073 | 90 | As is | in stock |
| P-904092982 | 98 | As is | 6 g |
| P-888524782 | 94 | As is | by resynthesis (? - ? days) |
| P-906887080 | 98 | As is | by synthesis |
| P-1550583 | 90 | As is | 15 mg |
| P-1271528209 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 210.316 |
| logP | 1.359 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 23.55 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 69.392 |
| Atoms | 37 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 22 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
