MCULE-6407005406
- 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 | 95 | 22 working days | Get Quote |
5 mg | 8 USD | 95 | 22 working days | Get Quote |
10 mg | 8 USD | 95 | 22 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-6407005406.sdf |
SMILES | MCULE-6407005406.smiles |
Standard InChI | MCULE-6407005406.inchi |
InChIKey | MCULE-6407005406.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867634824 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-875799638 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-580211229 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
P-606870816 | AmBeed | In stock | N/A | As is | in stock |
P-596995796 | Angene | Building Blocks in stock | 95 | As is | 189 g |
P-589661697 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-864110414 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-666964095 | BLD pharm | In-stock building blocks | 95 | As is | 26 g |
P-878240668 | CHESS Chem | All products | 98 | As is | in stock |
P-454684627 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-584581155 | ChemDiv | Discovery Chemistry Library | 90 | As is | unavailable |
P-436443183 | Chemical Block | Building Blocks | 90 | As is | 25.1 g |
P-313797 | Chemical Block | Screening Library | 90 | As is | 1.149 g |
P-896545251 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
P-34721619 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
P-580787765 | Crea-Chim | Building Blocks | 90 | As is | by resynthesis (? - ? days) |
P-580392160 | Debye Scientific | General Catalog | N/A | As is | by resynthesis (? - ? days) |
P-861973331 | FluoroChem | General BB | 95 | As is | in stock |
P-891375985 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
P-563534183 | Key Organics | Building Blocks | 95 | As is | 250 mg |
P-615654548 | LabNetwork | In stock | 95 | As is | in stock |
P-865619494 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
P-24061215 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-491225688 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-22618707 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
P-502337288 | TimTec | Building Block Collection | 90 | As is | in stock |
P-611592460 | Toronto Research | In stock | 90 | As is | in stock |
P-2140590 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 110 mg |
P-615455415 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 198.644 |
logP | 2.4456 |
H-bond acceptors | 2 |
H-bond donors | 0 |
Rotatable bonds | 4 |
PSA | 26.3 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 52.124 |
Atoms | 24 |
Rings | 1 |
Heavy atoms | 13 |
Hydrogen atoms | 11 |
Heteroatoms | 3 |
N/O atoms | 2 |
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 |