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DocumentationIdentifier: MM301636
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM301636 |
| SMILES |
C=CCCCC(C)C(=N)N
|
| InChIKey |
CYAZUJVCAQVGQV-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
1.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162123
Similarity: 0.8242
Similarity to MM162123
| Tanimoto metric | 0.8242 |
|---|---|
| Cosine metric | 0.9078 |
| Dice metric | 0.9036 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM254653
Similarity: 0.7813
Similarity to MM254653
| Tanimoto metric | 0.7813 |
|---|---|
| Cosine metric | 0.879 |
| Dice metric | 0.8772 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM254747
Similarity: 0.75
Similarity to MM254747
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.8593 |
| Dice metric | 0.8571 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+382 more
