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DocumentationIdentifier: MM165693
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM165693 |
| SMILES |
CC(CO)CCNC=N
|
| InChIKey |
VJWNMTVFIMMMSS-UHFFFAOYSA-N
|
| MW [Da] |
130.19
Automatically obtained from RDkit software. |
| LogP |
0.2
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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MM125572
Similarity: 0.7231
Similarity to MM125572
| Tanimoto metric | 0.7231 |
|---|---|
| Cosine metric | 0.8503 |
| Dice metric | 0.8393 |
| MW: | 116.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM155747
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| Tanimoto metric | 0.6962 |
|---|---|
| Cosine metric | 0.8213 |
| Dice metric | 0.8209 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.2 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM403267
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| Tanimoto metric | 0.6842 |
|---|---|
| Cosine metric | 0.8272 |
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| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+427 more
