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MCULE-7519582238
Compound
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- InChIKey:
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- InChI:
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2
MCULE-5646000632
- Component type: Unknown
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1
MCULE-4077812195
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-7519582238.sdf |
| SMILES | MCULE-7519582238.smiles |
| Standard InChI | MCULE-7519582238.inchi |
| InChIKey | MCULE-7519582238.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-579660905 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 68.145 |
| logP | 0.217 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 0 |
| PSA | 25.3 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 14.7596 |
| Atoms | 11 |
| Rings | 0 |
| Heavy atoms | 3 |
| Hydrogen atoms | 8 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
