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DocumentationIdentifier: MM389778
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM389778 |
| SMILES |
C=C(C)N(C=N)C(=C)CC
|
| InChIKey |
LCFLKODJLJVRDW-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.35
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM389780
Similarity: 0.6994
Similarity to MM389780
| Tanimoto metric | 0.6994 |
|---|---|
| Cosine metric | 0.826 |
| Dice metric | 0.8231 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM88207
Similarity: 0.6378
Similarity to MM88207
| Tanimoto metric | 0.6378 |
|---|---|
| Cosine metric | 0.7986 |
| Dice metric | 0.7788 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM378110
Similarity: 0.6323
Similarity to MM378110
| Tanimoto metric | 0.6323 |
|---|---|
| Cosine metric | 0.7747 |
| Dice metric | 0.7747 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+191 more
