MCULE-7124342199
- 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 | 51 USD | 90 | 19 working days | Get Quote |
10 mg | 65 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.
Name | File |
---|---|
SDF | MCULE-7124342199.sdf |
SMILES | MCULE-7124342199.smiles |
Standard InChI | MCULE-7124342199.inchi |
InChIKey | MCULE-7124342199.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867406212 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
P-867412674 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-874651412 | AK Scientific | Building Blocks | 97 | As is | in stock |
P-596464475 | Asinex | General screening catalog | 90 | As is | 1000 mg |
P-596498477 | Asinex | General bb catalog | 90 | As is | 1000 mg |
P-454759545 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-619342464 | ChemDiv | Discovery Chemistry Library | 90 | As is | 2 mg |
P-34572452 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
P-580768401 | Crea-Chim | Prepacked BB compounds with prompt delivery | 90 | As is | in stock |
P-580779212 | Crea-Chim | Building Blocks | 90 | As is | by resynthesis (? - ? days) |
P-488547952 | InterBioScreen | Building Blocks | 90 | As is | in stock |
P-13590428 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
P-596595099 | Key Organics | Building Blocks | 90 | As is | 500 mg |
P-580478422 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
P-852402922 | Matrix Scientific | All | N/A | As is | in stock |
P-854860422 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-454371115 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
P-23790052 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
P-23882126 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-491131870 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-502333543 | TimTec | Building Block Collection | 90 | As is | in stock |
P-22527112 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 50 mg |
P-1233405 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 176 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 267.282 |
logP | 2.4862 |
H-bond acceptors | 5 |
H-bond donors | 1 |
Rotatable bonds | 3 |
PSA | 68.01 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 75.2023 |
Atoms | 33 |
Rings | 3 |
Heavy atoms | 20 |
Hydrogen atoms | 13 |
Heteroatoms | 5 |
N/O atoms | 5 |
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 |