MCULE-3405235092
- 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 | 34 USD | 97 | 20 working days | Get Quote |
5 mg | 34 USD | 97 | 20 working days | Get Quote |
10 mg | 34 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-3405235092.sdf |
SMILES | MCULE-3405235092.smiles |
Standard InChI | MCULE-3405235092.inchi |
InChIKey | MCULE-3405235092.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867649380 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-875817105 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-590360993 | AK Scientific | Building Blocks | 97 | As is | in stock |
P-893576808 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 81 g |
P-580237000 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
P-606862901 | AmBeed | In stock | N/A | As is | in stock |
P-868831495 | Angene | Building Blocks in stock | 97 | As is | 40 g |
P-589663603 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-596448822 | Asinex | General screening catalog | 90 | As is | 1000 mg |
P-596496748 | Asinex | General bb catalog | 90 | As is | 1000 mg |
P-889525222 | AstaTech | In Stock BBs | 97 | As is | in stock |
P-492251211 | ChemBridge | Building Block Library | 95 | As is | in stock |
P-4142055 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | in stock |
P-861551926 | Combi-Blocks | Building Block on demand | 97 | As is | by synthesis |
P-580413982 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-861974154 | FluoroChem | General BB | N/A | As is | in stock |
P-502552580 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
P-563468293 | Key Organics | Building Blocks | 97 | As is | 1000 mg |
P-852387620 | Matrix Scientific | All | N/A | As is | in stock |
P-428013782 | Maybridge | Screening Collection | 90 | As is | unavailable |
P-867943612 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
P-888897430 | PharmaBlock | In stock | N/A | As is | in stock |
P-889865274 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-502334450 | TimTec | Building Block Collection | 90 | As is | in stock |
P-611397007 | Toronto Research | In stock | 90 | As is | in stock |
P-872759160 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 190.284 |
logP | 2.3793 |
H-bond acceptors | 2 |
H-bond donors | 1 |
Rotatable bonds | 3 |
PSA | 29.26 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 63.0064 |
Atoms | 32 |
Rings | 2 |
Heavy atoms | 14 |
Hydrogen atoms | 18 |
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 |