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DocumentationIdentifier: MM373786
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM373786 |
| SMILES |
C=C(CO)OC=CNC=N
|
| InChIKey |
RVXLBHDGVSRBJR-UHFFFAOYSA-N
|
| MW [Da] |
142.16
Automatically obtained from RDkit software. |
| LogP |
0.18
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM153766
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| Tanimoto metric | 0.7778 |
|---|---|
| Cosine metric | 0.8819 |
| Dice metric | 0.875 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Cosine metric | 0.8268 |
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| MW: | 143.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.27 |
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| AI: | 0
Total active interactions
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MM260048
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| Tanimoto metric | 0.6364 |
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| Cosine metric | 0.7778 |
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| MW: | 140.19 |
||||
|---|---|---|---|---|---|
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Total passive interactions
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| LogP: | 1.55 |
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|---|---|---|---|---|---|
| AI: | 0
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