MCULE-1530765033
- 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 | 19 working days | Get Quote |
5 mg | 35 USD | 95 | 14 working days | Get Quote |
10 mg | 41 USD | 95 | 14 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-1530765033.sdf |
SMILES | MCULE-1530765033.smiles |
Standard InChI | MCULE-1530765033.inchi |
InChIKey | MCULE-1530765033.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886571256 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
P-889909632 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
P-613852305 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-893484728 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 68.5 g |
P-19958394 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
P-436446793 | Alinda | Building Blocks | 95 | As is | 10 g |
P-851433453 | AmBeed | On request | N/A | As is | by synthesis |
P-881090003 | Angene | Building Blocks in stock | 97 | As is | 10 g |
P-596464404 | Asinex | General screening catalog | 90 | As is | 1000 mg |
P-889780744 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-590747460 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
P-504663942 | ChemBridge | RUSH - EXPRESS PICK LIBRARY | 85 | As is | 5 mg |
P-454692889 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-868636570 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
P-34487603 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
P-862061564 | FluoroChem | General BB | N/A | As is | in stock |
P-596587299 | Key Organics | Building Blocks | 90 | As is | 500 mg |
P-852397206 | Matrix Scientific | All | N/A | As is | in stock |
P-854841242 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-856063799 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 1.5 g |
P-23894968 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-519905148 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-22821394 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
P-873214250 | TimTec | Building Block Collection | 90 | As is | in stock |
P-888437157 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-611590130 | Toronto Research | In stock | 90 | As is | in stock |
P-1131292 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 3.639 g |
P-3226025 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 3.639 g |
P-894010028 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 194.226 |
logP | 2.1553 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 3 |
PSA | 46.53 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 54.2518 |
Atoms | 28 |
Rings | 1 |
Heavy atoms | 14 |
Hydrogen atoms | 14 |
Heteroatoms | 3 |
N/O atoms | 3 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 1 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 1 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |