MCULE-2198786398
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
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Guaranteed purity (%) | Delivery time
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1 mg | 35 USD | 90 | 17 working days | Get Quote |
5 mg | 45 USD | 90 | 22 working days | Get Quote |
10 mg | 60 USD | 90 | 22 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-2198786398.sdf |
SMILES | MCULE-2198786398.smiles |
Standard InChI | MCULE-2198786398.inchi |
InChIKey | MCULE-2198786398.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-4448846 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 100 mg |
P-503874218 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
P-31182217 | LaboTest | Screening Collection | 90 | As is | unavailable |
P-641716957 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
P-19194901 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-676486829 | Ultimate 3P | Express 1 | 90 | As is | by synthesis |
P-942193 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 71 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 259.728 |
logP | 4.2821 |
H-bond acceptors | 2 |
H-bond donors | 1 |
Rotatable bonds | 3 |
PSA | 29.1 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 75.5982 |
Atoms | 32 |
Rings | 2 |
Heavy atoms | 18 |
Hydrogen atoms | 14 |
Heteroatoms | 3 |
N/O atoms | 2 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
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 |