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DocumentationIdentifier: MM135225
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM135225 |
| SMILES |
CC(=N)NC(C)CCF
|
| InChIKey |
BULYYJVMHFCENB-UHFFFAOYSA-N
|
| MW [Da] |
132.18
Automatically obtained from RDkit software. |
| LogP |
1.32
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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MM221798
Similarity: 0.7699
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| Tanimoto metric | 0.7699 |
|---|---|
| Cosine metric | 0.8774 |
| Dice metric | 0.87 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM262207
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| Tanimoto metric | 0.7632 |
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| Cosine metric | 0.8736 |
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||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.49 |
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| AI: | 0
Total active interactions
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MM268503
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| Tanimoto metric | 0.7016 |
|---|---|
| Cosine metric | 0.8376 |
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| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+527 more
