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DocumentationIdentifier: MM406633
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM406633 |
| SMILES |
C=CC=CCN(C=N)CC
|
| InChIKey |
YRCOHSOSUNKOHB-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.66
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM168364
Similarity: 0.7875
Similarity to MM168364
| Tanimoto metric | 0.7875 |
|---|---|
| Cosine metric | 0.8874 |
| Dice metric | 0.8811 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM374586
Similarity: 0.7326
Similarity to MM374586
| Tanimoto metric | 0.7326 |
|---|---|
| Cosine metric | 0.848 |
| Dice metric | 0.8456 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM406707
Similarity: 0.6804
Similarity to MM406707
| Tanimoto metric | 0.6804 |
|---|---|
| Cosine metric | 0.81 |
| Dice metric | 0.8098 |
| MW: | 136.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+159 more
