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DocumentationIdentifier: MM406635
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM406635 |
| SMILES |
CCN(C=N)CC=CC#N
|
| InChIKey |
VVPZLJFMPPFIJY-UHFFFAOYSA-N
|
| MW [Da] |
137.19
Automatically obtained from RDkit software. |
| LogP |
1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM388302
Similarity: 0.699
Similarity to MM388302
| Tanimoto metric | 0.699 |
|---|---|
| Cosine metric | 0.8235 |
| Dice metric | 0.8229 |
| MW: | 137.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM406633
Similarity: 0.6735
Similarity to MM406633
| Tanimoto metric | 0.6735 |
|---|---|
| Cosine metric | 0.8051 |
| Dice metric | 0.8049 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM406707
Similarity: 0.6535
Similarity to MM406707
| Tanimoto metric | 0.6535 |
|---|---|
| Cosine metric | 0.7904 |
| Dice metric | 0.7904 |
| MW: | 136.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+141 more
