MCULE-3798789188-0
- 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 | 40 USD | N/A | 14 working days | Get Quote |
5 mg | 40 USD | N/A | 14 working days | Get Quote |
10 mg | 40 USD | N/A | 14 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-3798789188-0.sdf |
SMILES | MCULE-3798789188-0.smiles |
Standard InChI | MCULE-3798789188-0.inchi |
InChIKey | MCULE-3798789188-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-875716557 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869195117 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-575539411 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-610977432 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 142.58 g |
P-851928511 | AmBeed | In stock | N/A | As is | in stock |
P-597007185 | Angene | Building Blocks in stock | 95 | As is | 5 g |
P-494388419 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-864195845 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-619601248 | BLD pharm | In-stock building blocks | 95 | As is | unavailable |
P-579721740 | CNH Technologies | In-stock Building Blocks | N/A | As is | unavailable |
P-872748860 | Combi-Blocks | Building Block in stock | 96 | As is | in stock |
P-889290779 | FluoroChem | General BB | 97 | As is | in stock |
P-890218535 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
P-590340965 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 1000 mg |
P-596579388 | Key Organics | Building Blocks | 97 | As is | 250 mg |
P-579629004 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
P-852234458 | Life Chemicals | Screening Compounds | 90 | As is | 157 mg |
P-611664992 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
P-852410931 | Matrix Scientific | All | N/A | As is | in stock |
P-863704556 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
P-888887049 | PharmaBlock | In stock | N/A | As is | in stock |
P-859995009 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-855229820 | Toronto Research | In stock | 90 | As is | in stock |
P-893987234 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 271.695 |
logP | 3.4582 |
H-bond acceptors | 5 |
H-bond donors | 2 |
Rotatable bonds | 5 |
PSA | 75.63 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 68.657 |
Atoms | 32 |
Rings | 1 |
Heavy atoms | 18 |
Hydrogen atoms | 14 |
Heteroatoms | 6 |
N/O atoms | 5 |
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 |