MCULE-2175880497
- 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-2175880497.sdf |
SMILES | MCULE-2175880497.smiles |
Standard InChI | MCULE-2175880497.inchi |
InChIKey | MCULE-2175880497.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886093655 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-596255359 | Asinex | General screening catalog | 90 | As is | 39 mg |
P-619315310 | ChemDiv | Discovery Chemistry Library | 90 | As is | 20 mg |
P-324641 | Chemical Block | Screening Library | 90 | As is | 239 mg |
P-34724860 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
P-14572719 | Life Chemicals | Screening Compounds | 90 | As is | in stock |
P-13055469 | Otava | In-House Stock Library | 90 | As is | 100 mg |
P-19215865 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-33449268 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
P-502357266 | TimTec | Building Block Collection | 90 | As is | in stock |
P-873064377 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-22621547 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-873091581 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-1870299 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 957 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 423.933 |
logP | 4.9887 |
H-bond acceptors | 5 |
H-bond donors | 0 |
Rotatable bonds | 9 |
PSA | 47.36 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 124.67 |
Atoms | 56 |
Rings | 4 |
Heavy atoms | 30 |
Hydrogen atoms | 26 |
Heteroatoms | 6 |
N/O atoms | 5 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
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 |