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DocumentationIdentifier: MM320279
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM320279 |
| SMILES |
CN=C(C)NCC(N)CO
|
| InChIKey |
XUZHISXTFYSEQS-UHFFFAOYSA-N
|
| MW [Da] |
145.21
Automatically obtained from RDkit software. |
| LogP |
-1.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM144279
Similarity: 0.7719
Similarity to MM144279
| Tanimoto metric | 0.7719 |
|---|---|
| Cosine metric | 0.8786 |
| Dice metric | 0.8713 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM316497
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| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8005 |
| Dice metric | 0.8 |
| MW: | 145.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM251784
Similarity: 0.6667
Similarity to MM251784
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8015 |
| Dice metric | 0.8 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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+205 more
