MCULE-1526132721
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
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Guaranteed purity (%) | Delivery time
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1 mg | 35 USD | 90 | 19 working days | Get Quote |
5 mg | 52 USD | 90 | 19 working days | Get Quote |
10 mg | 66 USD | 90 | 19 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-1526132721.sdf |
SMILES | MCULE-1526132721.smiles |
Standard InChI | MCULE-1526132721.inchi |
InChIKey | MCULE-1526132721.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-584578406 | ChemDiv | Discovery Chemistry Library | 90 | As is | 6 mg |
P-279914 | Chemical Block | Screening Library | 90 | As is | 256 mg |
P-34712336 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
P-503124328 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
P-13163895 | Otava | In-House Stock Library | 90 | As is | 100 mg |
P-23851647 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-33449130 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
P-2137642 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 55 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 410.412 |
logP | 5.0039 |
H-bond acceptors | 5 |
H-bond donors | 2 |
Rotatable bonds | 9 |
PSA | 67.43 |
RO5 violations | 1 |
RO3 violations | 5 |
Refractivity | 107.6574 |
Atoms | 50 |
Rings | 3 |
Heavy atoms | 30 |
Hydrogen atoms | 20 |
Heteroatoms | 7 |
N/O atoms | 5 |
Inorganic atoms | 0 |
Halogen atoms | 2 |
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 |