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DocumentationIdentifier: MM236556
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM236556 |
| SMILES |
CCCCC(N)CC(=N)N
|
| InChIKey |
YMYSVNYPJAZTKF-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
0.83
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM135179
Similarity: 0.8851
Similarity to MM135179
| Tanimoto metric | 0.8851 |
|---|---|
| Cosine metric | 0.9408 |
| Dice metric | 0.939 |
| MW: | 129.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM236628
Similarity: 0.729
Similarity to MM236628
| Tanimoto metric | 0.729 |
|---|---|
| Cosine metric | 0.8447 |
| Dice metric | 0.8432 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM236693
Similarity: 0.7264
Similarity to MM236693
| Tanimoto metric | 0.7264 |
|---|---|
| Cosine metric | 0.8425 |
| Dice metric | 0.8415 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+326 more
