MCULE-9632275130
- 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 | 67 USD | 90 | 19 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-9632275130.sdf |
SMILES | MCULE-9632275130.smiles |
Standard InChI | MCULE-9632275130.inchi |
InChIKey | MCULE-9632275130.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-13118872 | Otava | In-House Stock Library | 90 | As is | 193 mg |
P-18865414 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-12889888 | Specs | Screening Compounds | 90 | As is | 86 mg |
P-613608 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 96 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 354.484 |
logP | 3.0893 |
H-bond acceptors | 6 |
H-bond donors | 2 |
Rotatable bonds | 14 |
PSA | 76.66 |
RO5 violations | 0 |
RO3 violations | 5 |
Refractivity | 97.3924 |
Atoms | 59 |
Rings | 2 |
Heavy atoms | 25 |
Hydrogen atoms | 34 |
Heteroatoms | 6 |
N/O atoms | 6 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 2 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 2 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |