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DocumentationIdentifier: MM283865
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM283865 |
| SMILES |
CCC=C(C)NC=NCC
|
| InChIKey |
CCIKZCFWMLKMOA-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
1.94
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM168945
Similarity: 0.7849
Similarity to MM168945
| Tanimoto metric | 0.7849 |
|---|---|
| Cosine metric | 0.886 |
| Dice metric | 0.8795 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM360649
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| Tanimoto metric | 0.7168 |
|---|---|
| Cosine metric | 0.8358 |
| Dice metric | 0.8351 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM360607
Similarity: 0.7168
Similarity to MM360607
| Tanimoto metric | 0.7168 |
|---|---|
| Cosine metric | 0.8358 |
| Dice metric | 0.8351 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+444 more
