MCULE-1577784164
- 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.
-
MCULE-7320743030
- Component type: Main
Name | File |
---|---|
SDF | MCULE-1577784164.sdf |
SMILES | MCULE-1577784164.smiles |
Standard InChI | MCULE-1577784164.inchi |
InChIKey | MCULE-1577784164.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867542710 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875699643 | AA Blocks | AA Blocks | N/A | As is | in stock |
P-590369202 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-888179905 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
P-606920387 | AmBeed | In stock | N/A | As is | in stock |
P-489173998 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-596938723 | Angene | Building Blocks in stock | 97 | As is | 21.25 g |
P-494328798 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-864116392 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-580733884 | BLD pharm | In-stock building blocks | 98 | As is | 20.25 g |
P-454633028 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-619827358 | ChemDiv | Discovery Chemistry Library | 90 | As is | 6.995 g |
P-868612533 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
P-580296106 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-862026782 | FluoroChem | All BB | 98 | As is | in stock |
P-454403042 | Key Organics | Building Blocks | 95 | As is | 82.529 g |
P-18792684 | Key Organics | Screening Compounds and Fragments | 95 | As is | 82.529 g |
P-852406991 | Matrix Scientific | All | N/A | As is | in stock |
P-854740010 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
P-859997930 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-873280677 | Shanghai iChemical | In stock | N/A | As is | in stock |
P-502358747 | TimTec | Building Block Collection | 90 | As is | in stock |
P-611439395 | Toronto Research | In stock | 90 | As is | in stock |
P-611395120 | Toronto Research | In stock | 90 | As is | in stock |
P-676777252 | Ultimate 3P | Express 1 | 90 | As is | by synthesis |
P-481011709 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 158.199 |
logP | 2.3851 |
H-bond acceptors | 2 |
H-bond donors | 1 |
Rotatable bonds | 1 |
PSA | 28.68 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 48.9897 |
Atoms | 22 |
Rings | 2 |
Heavy atoms | 12 |
Hydrogen atoms | 10 |
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 |