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DocumentationIdentifier: MM114130
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM114130 |
| SMILES |
CN(C=N)C=CCN
|
| InChIKey |
FOYNNWUVEMOLOW-UHFFFAOYSA-N
|
| MW [Da] |
113.16
Automatically obtained from RDkit software. |
| LogP | N/A |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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| Tanimoto metric | 0.8413 |
|---|---|
| Cosine metric | 0.9172 |
| Dice metric | 0.9138 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.51 |
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| AI: | 0
Total active interactions
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| Tanimoto metric | 0.7571 |
|---|---|
| Cosine metric | 0.8701 |
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.65 |
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|---|---|---|---|---|---|
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Total active interactions
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+353 more
