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DocumentationIdentifier: MM89647
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM89647 |
| SMILES |
C=CCNC(=N)C(C)OC
|
| InChIKey |
BANOGYMYCDZANS-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.77
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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MM350197
Similarity: 0.7415
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| Tanimoto metric | 0.7415 |
|---|---|
| Cosine metric | 0.8518 |
| Dice metric | 0.8516 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM292844
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| Tanimoto metric | 0.7237 |
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| Cosine metric | 0.8397 |
| Dice metric | 0.8397 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM350195
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Similarity to MM350195
| Tanimoto metric | 0.7124 |
|---|---|
| Cosine metric | 0.8321 |
| Dice metric | 0.8321 |
| MW: | 145.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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