MCULE-7680414780-0
- 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 | 66 USD | 95 | 10 working days | Get Quote |
5 mg | 74 USD | 95 | 19 working days | Get Quote |
10 mg | 74 USD | 95 | 19 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-7680414780-0.sdf |
SMILES | MCULE-7680414780-0.smiles |
Standard InChI | MCULE-7680414780-0.inchi |
InChIKey | MCULE-7680414780-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-875744399 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869300434 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-893534014 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 2 g |
P-851681713 | AmBeed | On request | N/A | As is | by synthesis |
P-596976315 | Angene | Building Blocks in stock | 97 | As is | 1000 mg |
P-864163712 | AstaTech | In Stock BBs | 97 | As is | in stock |
P-889740463 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 17.75 g |
P-591102046 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
P-861509221 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-580277042 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-889379609 | FluoroChem | General BB | 97 | As is | in stock |
P-502528291 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
P-870641443 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
P-856040969 | LaboTest | Building Blocks | 90 | As is | 5 g |
P-31179357 | LaboTest | Screening Collection | 90 | As is | 5 g |
P-854921952 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-888842452 | PharmaBlock | On demand | N/A | As is | by synthesis |
P-870521342 | Synthonix | In-stock Building Blocks | 97 | As is | 1000 mg |
P-502366042 | TimTec | Building Block Collection | 90 | As is | in stock |
P-611572482 | Toronto Research | In stock | 90 | As is | in stock |
P-575329717 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 165.189 |
logP | 1.85528 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 1 |
PSA | 61.09 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 44.3098 |
Atoms | 23 |
Rings | 1 |
Heavy atoms | 12 |
Hydrogen atoms | 11 |
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 |