MCULE-3335810526-0
- 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 | 10 USD | 97 | 20 working days | Get Quote |
5 mg | 10 USD | 97 | 20 working days | Get Quote |
10 mg | 10 USD | 97 | 20 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-3335810526-0.sdf |
SMILES | MCULE-3335810526-0.smiles |
Standard InChI | MCULE-3335810526-0.inchi |
InChIKey | MCULE-3335810526-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867564722 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-875724306 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869189656 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-505347170 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-893464988 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 2.40108 kg |
P-606841183 | AmBeed | In stock | N/A | As is | in stock |
P-489169565 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-596979092 | Angene | Building Blocks in stock | 97 | As is | 200 g |
P-895927300 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-895927311 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-864098604 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-851286400 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-868585062 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
P-580281626 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-579621086 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
P-468066901 | Life Chemicals | Building Blocks | 90 | As is | 14.76 g |
P-601043685 | Life Chemicals | Screening Compounds | 90 | As is | 14.76 g |
P-580516383 | Manchester Organics | Stock compounds | 95 | As is | 103 g |
P-852481898 | Matrix Scientific | All | N/A | As is | in stock |
P-854727548 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
P-888860158 | PharmaBlock | In stock | N/A | As is | in stock |
P-889865210 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-613814500 | Spirochem | All | 95 | As is | in stock |
P-498678216 | Synthonix | In-stock Building Blocks | 97 | As is | 208 g |
P-873224152 | TimTec | Building Block Collection | 90 | As is | in stock |
P-855044847 | Toronto Research | In stock | 90 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 81.116 |
logP | 1.31008 |
H-bond acceptors | 1 |
H-bond donors | 0 |
Rotatable bonds | 0 |
PSA | 23.79 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 23.784 |
Atoms | 13 |
Rings | 1 |
Heavy atoms | 6 |
Hydrogen atoms | 7 |
Heteroatoms | 1 |
N/O atoms | 1 |
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 |