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DocumentationIdentifier: MM238449
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM238449 |
| SMILES |
C=C(C)C=C(C)CNC=N
|
| InChIKey |
WAEHDQSGMPBCSR-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.71
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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MM158957
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Similarity to MM158957
| Tanimoto metric | 0.7353 |
|---|---|
| Cosine metric | 0.8575 |
| Dice metric | 0.8475 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM360297
Similarity: 0.6757
Similarity to MM360297
| Tanimoto metric | 0.6757 |
|---|---|
| Cosine metric | 0.8103 |
| Dice metric | 0.8065 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM238360
Similarity: 0.6609
Similarity to MM238360
| Tanimoto metric | 0.6609 |
|---|---|
| Cosine metric | 0.7977 |
| Dice metric | 0.7958 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+220 more
