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DocumentationIdentifier: MM350143
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM350143 |
| SMILES |
CCC(N)C(=N)NCCF
|
| InChIKey |
FVXQHBJXHJTVIN-UHFFFAOYSA-N
|
| MW [Da] |
147.2
Automatically obtained from RDkit software. |
| LogP |
0.26
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162406
Similarity: 0.7742
Similarity to MM162406
| Tanimoto metric | 0.7742 |
|---|---|
| Cosine metric | 0.8799 |
| Dice metric | 0.8727 |
| MW: | 133.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350657
Similarity: 0.6779
Similarity to MM350657
| Tanimoto metric | 0.6779 |
|---|---|
| Cosine metric | 0.808 |
| Dice metric | 0.808 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM89553
Similarity: 0.6779
Similarity to MM89553
| Tanimoto metric | 0.6779 |
|---|---|
| Cosine metric | 0.808 |
| Dice metric | 0.808 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+381 more
