Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4265681704
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 | 13 USD | 97 | 11 working days | Get Quote |
| 5 mg | 13 USD | 97 | 11 working days | Get Quote |
| 10 mg | 13 USD | 97 | 11 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.
| Name | File |
|---|---|
| SDF | MCULE-4265681704.sdf |
| SMILES | MCULE-4265681704.smiles |
| Standard InChI | MCULE-4265681704.inchi |
| InChIKey | MCULE-4265681704.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867565852 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-852186350 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-852187688 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-875725584 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869186563 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-590379767 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-901550707 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-893260769 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-874568971 | ChemDiv | Discovery Chemistry Library | 90 | As is | 50 mg |
| P-868611591 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-580403128 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-901374076 | FluoroChem | In Stock BB | N/A | As is | 239.35 g |
| P-488544556 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-13832648 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-524163113 | Key Organics | Building Blocks | 97 | As is | 25 g |
| P-524163114 | Key Organics | Building Blocks | 98 | As is | 25 g |
| P-855992407 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-855992408 | Key Organics | Screening Compounds and Fragments | 98 | As is | 100 mg |
| P-579611920 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-856041618 | LaboTest | Building Blocks | 90 | As is | 10 g |
| P-31275516 | LaboTest | Screening Collection | 90 | As is | 10 g |
| P-613284638 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-852505028 | Matrix Scientific | All | N/A | As is | in stock |
| P-888171887 | Molnova | On demand | 98 | As is | by synthesis |
| P-620218523 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1000 mg |
| P-619999200 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
| P-454364164 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-864651184 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-519886762 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885544350 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-611390397 | Toronto Research | In stock | 90 | As is | in stock |
| P-855254196 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 120.148 |
| logP | 1.7579 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 12.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 35.186 |
| Atoms | 17 |
| Rings | 2 |
| Heavy atoms | 9 |
| Hydrogen atoms | 8 |
| Heteroatoms | 1 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
