MCULE-6797850777-0
- 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 | 7 USD | N/A | 9 working days | Get Quote |
5 mg | 7 USD | N/A | 9 working days | Get Quote |
10 mg | 7 USD | N/A | 9 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.
-
MCULE-6046117534-0
- Component type: Main
-
MCULE-7577650473-0
- Component type: Main
-
MCULE-4375643069-0
- Component type: Main
Name | File |
---|---|
SDF | MCULE-6797850777-0.sdf |
SMILES | MCULE-6797850777-0.smiles |
Standard InChI | MCULE-6797850777-0.inchi |
InChIKey | MCULE-6797850777-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867396244 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
P-853429054 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-893442974 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 2.1 g |
P-851515609 | AmBeed | On request | N/A | As is | by synthesis |
P-892190211 | Angene | Building Blocks in stock | 95 | As is | 2 g |
P-872724187 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
P-896024439 | AstaTech | In Stock BBs | 98 | As is | in stock |
P-590784240 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
P-893625531 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-854707798 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
P-869127532 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
P-888640598 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
P-875792792 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
P-489126929 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As a main component | in stock |
P-580697488 | BLD pharm | In-stock building blocks | 98 | As a main component | unavailable |
P-851278541 | Chemshuttle | On request catalog | 95 | As a main component | by synthesis |
P-861429621 | Combi-Blocks | Building Block on demand | 95 | As a main component | by synthesis |
P-579480783 | DC Chemicals Limited | Stock Products | 95 | As a main component | in stock |
P-505522421 | Hangzhou Apichem | Building Blocks in stock | 95 | As a main component | in stock |
P-579628747 | LabSeeker, Inc | Stock Collection | 95 | As a main component | in stock |
P-854717184 | MedChemExpress | Screening compounds In stock | 95 | As a main component | in stock |
P-474021241 | MedKoo | In stock compounds | 95 | As a main component | in stock |
P-608275209 | Molnova | Stock | 98 | As a main component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 290.401 |
logP | 3.6456 |
H-bond acceptors | 2 |
H-bond donors | 0 |
Rotatable bonds | 0 |
PSA | 16.13 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 95.365 |
Atoms | 44 |
Rings | 4 |
Heavy atoms | 22 |
Hydrogen atoms | 22 |
Heteroatoms | 2 |
N/O atoms | 2 |
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 |