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DocumentationIdentifier: MM375746
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM375746 |
| SMILES |
CCCC(NC)C(N)CN
|
| InChIKey |
MKSRDDCSGYMEOR-UHFFFAOYSA-N
|
| MW [Da] |
145.25
Automatically obtained from RDkit software. |
| LogP |
-0.34
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM94399
Similarity: 0.7778
Similarity to MM94399
| Tanimoto metric | 0.7778 |
|---|---|
| Cosine metric | 0.8819 |
| Dice metric | 0.875 |
| MW: | 130.24 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM94488
Similarity: 0.7431
Similarity to MM94488
| Tanimoto metric | 0.7431 |
|---|---|
| Cosine metric | 0.8534 |
| Dice metric | 0.8526 |
| MW: | 144.26 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM74367
Similarity: 0.725
Similarity to MM74367
| Tanimoto metric | 0.725 |
|---|---|
| Cosine metric | 0.8414 |
| Dice metric | 0.8406 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+428 more
