MCULE-4193075350-0
- 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 | 33 USD | 90 | 23 working days | Get Quote |
5 mg | 52 USD | 90 | 19 working days | Get Quote |
10 mg | 66 USD | 90 | 19 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.
-
1
MCULE-7920922368-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
Name | File |
---|---|
SDF | MCULE-4193075350-0.sdf |
SMILES | MCULE-4193075350-0.smiles |
Standard InChI | MCULE-4193075350-0.inchi |
InChIKey | MCULE-4193075350-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886724563 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-890023094 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
P-869224744 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-851841244 | AmBeed | On request | N/A | As is | by synthesis |
P-889801020 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-591003244 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-580089418 | Eximed | Building Block Catalog | 95 | As is | 400 mg |
P-579803346 | Eximed | In-stock screening compounds | 90 | As is | 400 mg |
P-580005026 | Innovapharm | Building Blocks | 95 | As is | in stock |
P-580045157 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-488551433 | InterBioScreen | Building Blocks | 90 | As is | in stock |
P-24437605 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
P-563683497 | Key Organics | Building Blocks | 95 | As is | 100 mg |
P-895482625 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-26390887 | Otava | In-House Stock Library | 90 | As is | 400 mg |
P-492275685 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 978 mg |
P-620068713 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
P-454369476 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
P-14000082 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
P-617779510 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.032 g |
P-617715810 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.032 g |
P-893728330 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
P-893048321 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
P-851712989 | AmBeed | On request | N/A | Main component | by synthesis |
P-577147104 | ChemDiv | Building Blocks on demand | 90 | Main component | by synthesis |
P-580315308 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
P-502535996 | Innovapharm | Virtual Building Blocks | 95 | Main component | by synthesis |
P-895552164 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
P-424944778 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
P-502379067 | TimTec | Building Block Collection | 90 | Main component | in stock |
Property | Value |
---|---|
Components | 2 |
Mass | 239.700 |
logP | 3.1302 |
H-bond acceptors | 4 |
H-bond donors | 1 |
Rotatable bonds | 4 |
PSA | 64.94 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 63.9864 |
Atoms | 30 |
Rings | 2 |
Heavy atoms | 16 |
Hydrogen atoms | 14 |
Heteroatoms | 5 |
N/O atoms | 4 |
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 |