MCULE-5572375269
- 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 | 52 USD | 90 | 17 working days | Get Quote |
10 mg | 67 USD | 90 | 17 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-5572375269.sdf |
SMILES | MCULE-5572375269.smiles |
Standard InChI | MCULE-5572375269.inchi |
InChIKey | MCULE-5572375269.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-865983149 | AsisChem | In-stock Compounds for biological screening | 95 | As is | in stock |
P-19538987 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-22889428 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
P-1283413 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 192 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 405.402 |
logP | 3.2748 |
H-bond acceptors | 8 |
H-bond donors | 3 |
Rotatable bonds | 9 |
PSA | 117.09 |
RO5 violations | 0 |
RO3 violations | 5 |
Refractivity | 112.3509 |
Atoms | 49 |
Rings | 3 |
Heavy atoms | 30 |
Hydrogen atoms | 19 |
Heteroatoms | 8 |
N/O atoms | 8 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 0 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 0 |
Stereo double bonds | 1 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 1 |
Undefined stereo double bonds | 0 |