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DocumentationIdentifier: MM363585
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM363585 |
| SMILES |
C=CN(C)C=NCCCC
|
| InChIKey |
BEQRAKCGQXMMMR-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
1.89
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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MM169649
Similarity: 0.8784
Similarity to MM169649
| Tanimoto metric | 0.8784 |
|---|---|
| Cosine metric | 0.9372 |
| Dice metric | 0.9353 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM425787
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| Tanimoto metric | 0.7927 |
|---|---|
| Cosine metric | 0.8844 |
| Dice metric | 0.8844 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.01 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM259836
Similarity: 0.7738
Similarity to MM259836
| Tanimoto metric | 0.7738 |
|---|---|
| Cosine metric | 0.8725 |
| Dice metric | 0.8725 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+341 more
