Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3507644812-0
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 | 8 USD | 85 | 20 working days | Get Quote |
| 5 mg | 8 USD | 85 | 20 working days | Get Quote |
| 10 mg | 8 USD | 85 | 20 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-3507644812-0.sdf |
| SMILES | MCULE-3507644812-0.smiles |
| Standard InChI | MCULE-3507644812-0.inchi |
| InChIKey | MCULE-3507644812-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867564001 | A2B Chem | Predominantly Building Block in stock | 85 | As is | in stock |
| P-875723187 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590371271 | AK Scientific | Building Blocks | 85 | As is | in stock |
| P-580197680 | Aldlab Chemicals | Building Block Stock | 95 | As is | 70 g |
| P-606868726 | AmBeed | In stock | N/A | As is | in stock |
| P-489183344 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-865907398 | Angene | Building Blocks in stock | 85 | As is | 375 g |
| P-494333643 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864131934 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-893246524 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-454678755 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-436441050 | Chemical Block | Building Blocks | 90 | As is | 4.87 kg |
| P-868614927 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-580424123 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862084701 | FluoroChem | General BB | 80 | As is | in stock |
| P-870658706 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-492243485 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-454392522 | Key Organics | Building Blocks | 85 | As is | 6.32 g |
| P-608085049 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-31274310 | LaboTest | Screening Collection | 90 | As is | 10 g |
| P-856039538 | LaboTest | Building Blocks | 90 | As is | 10 g |
| P-613283898 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-580517027 | Manchester Organics | Stock compounds | 90 | As is | 195 g |
| P-852496993 | Matrix Scientific | All | N/A | As is | in stock |
| P-854725701 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-621857845 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
| P-620224013 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1000 mg |
| P-34030705 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
| P-500381557 | Pi Chemicals | Virtual Compounds | 85 | As is | by synthesis |
| P-892263771 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892345078 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-502328124 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611466854 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 108.565 |
| logP | 0.9977 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 20.23 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 27.2998 |
| Atoms | 15 |
| Rings | 0 |
| Heavy atoms | 6 |
| Hydrogen atoms | 9 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
