MCULE-1694297418
- 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.
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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.
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1 mg | 33 USD | 90 | 19 working days | Get Quote |
5 mg | 49 USD | 90 | 19 working days | Get Quote |
10 mg | 62 USD | 90 | 19 working days | Get Quote |
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Name | File |
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SDF | MCULE-1694297418.sdf |
SMILES | MCULE-1694297418.smiles |
Standard InChI | MCULE-1694297418.inchi |
InChIKey | MCULE-1694297418.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886279905 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-596416298 | Asinex | General screening catalog | 90 | As is | 4 mg |
P-5826973 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
P-4328912 | ChemDiv | Discovery Chemistry Library | 90 | As is | unavailable |
P-502805595 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-14196531 | Life Chemicals | Screening Compounds | 90 | As is | in stock |
P-12964333 | Otava | In-House Stock Library | 90 | As is | 205 mg |
P-18847221 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-33813375 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
P-2583466 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 98 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 324.330 |
logP | 2.2231 |
H-bond acceptors | 6 |
H-bond donors | 1 |
Rotatable bonds | 3 |
PSA | 67.87 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 92.9577 |
Atoms | 40 |
Rings | 4 |
Heavy atoms | 24 |
Hydrogen atoms | 16 |
Heteroatoms | 6 |
N/O atoms | 6 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 3 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 3 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |