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DocumentationIdentifier: MM262107
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM262107 |
| SMILES |
C=CCN(C)CC(=C)CN
|
| InChIKey |
IXXVOCPSWGUBMR-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
0.62
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM68629
Similarity: 0.8675
Similarity to MM68629
| Tanimoto metric | 0.8675 |
|---|---|
| Cosine metric | 0.9314 |
| Dice metric | 0.929 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328852
Similarity: 0.809
Similarity to MM328852
| Tanimoto metric | 0.809 |
|---|---|
| Cosine metric | 0.8948 |
| Dice metric | 0.8944 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM71272
Similarity: 0.7912
Similarity to MM71272
| Tanimoto metric | 0.7912 |
|---|---|
| Cosine metric | 0.8836 |
| Dice metric | 0.8834 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+300 more
