MCULE-8954037729
- 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 | 45 USD | 90 | 23 working days | Get Quote |
5 mg | 72 USD | 96 | 9 working days | Get Quote |
10 mg | 72 USD | 96 | 9 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-8954037729.sdf |
SMILES | MCULE-8954037729.smiles |
Standard InChI | MCULE-8954037729.inchi |
InChIKey | MCULE-8954037729.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867639680 | A2B Chem | Predominantly Building Block in stock | N/A | As is | in stock |
P-875805279 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-851694542 | AmBeed | On request | N/A | As is | by synthesis |
P-596362467 | Asinex | General screening catalog | 90 | As is | unavailable |
P-580281127 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-862054131 | FluoroChem | General BB | N/A | As is | in stock |
P-494299839 | Frinton Laboratories | Frinton Building Blocks | 96 | As is | in stock |
P-852550302 | Matrix Scientific | All | N/A | As is | in stock |
P-12344376 | Otava | In-House Stock Library | 90 | As is | 1 mg |
P-18982591 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-502331983 | TimTec | Building Block Collection | 90 | As is | in stock |
P-873063640 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-23141357 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-611384420 | Toronto Research | In stock | 90 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 231.290 |
logP | 1.6308 |
H-bond acceptors | 3 |
H-bond donors | 2 |
Rotatable bonds | 5 |
PSA | 43.7 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 70.0926 |
Atoms | 34 |
Rings | 2 |
Heavy atoms | 17 |
Hydrogen atoms | 17 |
Heteroatoms | 3 |
N/O atoms | 3 |
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 |