MCULE-6925904637
- 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 | 35 USD | 90 | 17 working days | Get Quote |
5 mg | 35 USD | 90 | 17 working days | Get Quote |
10 mg | 41 USD | 90 | 17 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-4248342442
- Component type: Main
-
MCULE-8601742568
- Component type: Main
Name | File |
---|---|
SDF | MCULE-6925904637.sdf |
SMILES | MCULE-6925904637.smiles |
Standard InChI | MCULE-6925904637.inchi |
InChIKey | MCULE-6925904637.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-852180314 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
P-889952171 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
P-869328369 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-675062002 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
P-851467887 | AmBeed | On request | N/A | As is | by synthesis |
P-590762155 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
P-454712862 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-12543042 | InterBioScreen | Screening Compounds | 92 | As is | 205 mg |
P-852448979 | Matrix Scientific | All | N/A | As is | in stock |
P-854924955 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-855311905 | Toronto Research | In stock | 90 | As is | in stock |
P-3244838 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 75 mg |
P-25006511 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 75 mg |
P-862073880 | FluoroChem | General BB | 95 | As a main component | in stock |
P-856012143 | LaboTest | Screening Collection | 90 | As a main component | 200 mg |
P-675091930 | Princeton Biomolecular Research | Screening Compounds | 90 | As a main component | in stock |
P-617595368 | Specs | Screening Compounds | 90 | As a main component | 129 mg |
P-873225562 | TimTec | Building Block Collection | 90 | As a main component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 187.193 |
logP | -0.1945 |
H-bond acceptors | 5 |
H-bond donors | 2 |
Rotatable bonds | 3 |
PSA | 77.84 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 48.8106 |
Atoms | 26 |
Rings | 1 |
Heavy atoms | 13 |
Hydrogen atoms | 13 |
Heteroatoms | 5 |
N/O atoms | 5 |
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 |