Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
UNKNOWN STEREO
MCULE-1674796104
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 | 17 USD | N/A | 9 working days | Get Quote |
| 5 mg | 17 USD | N/A | 9 working days | Get Quote |
| 10 mg | 17 USD | N/A | 9 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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-6602875097
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1674796104.sdf |
| SMILES | MCULE-1674796104.smiles |
| Standard InChI | MCULE-1674796104.inchi |
| InChIKey | MCULE-1674796104.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-861033114 | Chiralstar | Chiralstar Building Blocks | 95 | As is | in stock |
| P-867560916 | A2B Chem | Predominantly Building Block in stock | 98 | Main component | in stock |
| P-875721610 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-535625278 | AK Scientific | Building Blocks | 98 | Main component | in stock |
| P-505404096 | AK Scientific | Building Blocks | 98 | Main component | in stock |
| P-505404526 | AK Scientific | Building Blocks | N/A | Main component | in stock |
| P-580238694 | Aldlab Chemicals | Building Block Custom Synth | 95 | Main component | by synthesis |
| P-864187574 | AstaTech | In Stock BBs | 98 | Main component | in stock |
| P-893260527 | Biosynth | Synthesis | 95 | Main component | by synthesis |
| P-580289833 | Debye Scientific | General Catalog | N/A | Main component | by resynthesis (? - ? days) |
| P-505491425 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component | in stock |
| P-13877189 | InterBioScreen | Building Blocks | 90 | Main component | in stock |
| P-613282661 | Life Chemicals | Building Blocks - virtual | 95 | Main component | by synthesis |
| P-428093224 | Maybridge | Screening Collection | 95 | Main component | 11.273 kg |
| P-500372829 | Pi Chemicals | Virtual Compounds | 98 | Main component | by synthesis |
| P-611353871 | Toronto Research | In stock | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 157.639 |
| logP | 3.2086 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 26.02 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 45.8874 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 12 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
