MCULE-9493670953-0
- 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 | 14 USD | 97 | 20 working days | Get Quote |
5 mg | 14 USD | 97 | 20 working days | Get Quote |
10 mg | 14 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-9493670953-0.sdf |
SMILES | MCULE-9493670953-0.smiles |
Standard InChI | MCULE-9493670953-0.inchi |
InChIKey | MCULE-9493670953-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867662813 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
P-875831838 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869202176 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-893550360 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 51.83 g |
P-436470873 | Alinda | Building Blocks | 95 | As is | in stock |
P-606927627 | AmBeed | In stock | N/A | As is | in stock |
P-596973211 | Angene | Building Blocks in stock | 97 | As is | 5 g |
P-895941341 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-864193509 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-590636175 | BLD pharm | In-stock building blocks | 97 | As is | 1.35 g |
P-492260862 | ChemBridge | Building Block Library | 95 | As is | in stock |
P-454725947 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-868576248 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
P-862042303 | FluoroChem | General BB | 95 | As is | in stock |
P-890215616 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
P-590338047 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 1000 mg |
P-488551314 | InterBioScreen | Building Blocks | 90 | As is | in stock |
P-13768529 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
P-596571781 | Key Organics | Building Blocks | 97 | As is | 100 mg |
P-852449756 | Matrix Scientific | All | N/A | As is | in stock |
P-854758681 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
P-888898867 | PharmaBlock | In stock | N/A | As is | in stock |
P-454372312 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
P-23787773 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
P-605215134 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-859993141 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-873286175 | Shanghai iChemical | In stock | N/A | As is | in stock |
P-855014982 | Toronto Research | In stock | 90 | As is | in stock |
P-35134724 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 110 mg |
P-615456703 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 170.595 |
logP | 1.4855 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 2 |
PSA | 41.99 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 42.2432 |
Atoms | 18 |
Rings | 1 |
Heavy atoms | 11 |
Hydrogen atoms | 7 |
Heteroatoms | 4 |
N/O atoms | 3 |
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 |