MCULE-2199269675
- 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 | 34 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 |
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Name | File |
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SDF | MCULE-2199269675.sdf |
SMILES | MCULE-2199269675.smiles |
Standard InChI | MCULE-2199269675.inchi |
InChIKey | MCULE-2199269675.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-596451738 | Asinex | General screening catalog | 90 | As is | 107 mg |
P-7528972 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 50 mg |
P-619316756 | ChemDiv | Discovery Chemistry Library | 90 | As is | 14 mg |
P-323846 | Chemical Block | Screening Library | 90 | As is | 239 mg |
P-34724582 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
P-13020092 | Otava | In-House Stock Library | 90 | As is | 40 mg |
P-19112575 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-23543891 | Specs | Screening Compounds | 90 | As is | 20 mg |
P-33444529 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
P-873072221 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-22621309 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-1855416 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 189 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 324.416 |
logP | 4.2572 |
H-bond acceptors | 4 |
H-bond donors | 1 |
Rotatable bonds | 7 |
PSA | 47.28 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 97.3298 |
Atoms | 48 |
Rings | 3 |
Heavy atoms | 24 |
Hydrogen atoms | 24 |
Heteroatoms | 4 |
N/O atoms | 4 |
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 |