MCULE-5919336413-0
- 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 | 19 working days | Get Quote |
5 mg | 34 USD | 98 | 20 working days | Get Quote |
10 mg | 34 USD | 98 | 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.
-
1
MCULE-4116304866-0
- Component type: Main
-
1
MCULE-7728164114-0
- Component type: Counter Ion
Name | File |
---|---|
SDF | MCULE-5919336413-0.sdf |
SMILES | MCULE-5919336413-0.smiles |
Standard InChI | MCULE-5919336413-0.inchi |
InChIKey | MCULE-5919336413-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-875802535 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869361025 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-851954646 | AmBeed | In stock | N/A | As is | in stock |
P-619160613 | Angene | Building Blocks in stock | 98 | As is | 15 g |
P-864193645 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-608391699 | BLD pharm | In-stock building blocks | 98 | As is | 1000 mg |
P-893250736 | Biosynth | Synthesis | 95 | As is | by synthesis |
P-861390261 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-889361042 | FluoroChem | General BB | 98 | As is | in stock |
P-855963491 | Key Organics | Building Blocks | 97 | As is | 1000 mg |
P-854806409 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-855216497 | Toronto Research | In stock | 90 | As is | in stock |
P-872937107 | A2B Chem | Predominantly Building Block on demand | N/A | Main component as a main component | by synthesis |
P-894630996 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
P-851543845 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
P-611055608 | BLD pharm | Non-stock building blocks | 95 | Main component as a main component | by synthesis |
P-502589208 | Innovapharm | Virtual Building Blocks | 95 | Main component as a main component | by synthesis |
P-24172745 | InterBioScreen | Screening Compounds | 92 | Main component as a main component | 205 mg |
P-13332623 | Pharmeks LLC | Synthetic compounds | 92 | Main component as a main component | 205 mg |
P-617784094 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component as a main component | 75 mg |
Property | Value |
---|---|
Components | 2 |
Mass | 239.695 |
logP | -2.8954 |
H-bond acceptors | 5 |
H-bond donors | 1 |
Rotatable bonds | 7 |
PSA | 63.6 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 57.7732 |
Atoms | 33 |
Rings | 0 |
Heavy atoms | 15 |
Hydrogen atoms | 18 |
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 |