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DocumentationIdentifier: MM316294
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM316294 |
| SMILES |
C=C(CC)CCC(N)CN
|
| InChIKey |
SMKVXFVRVPNFRV-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
1.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM250854
Similarity: 0.7976
Similarity to MM250854
| Tanimoto metric | 0.7976 |
|---|---|
| Cosine metric | 0.8907 |
| Dice metric | 0.8874 |
| MW: | 141.26 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM144590
Similarity: 0.7927
Similarity to MM144590
| Tanimoto metric | 0.7927 |
|---|---|
| Cosine metric | 0.8903 |
| Dice metric | 0.8844 |
| MW: | 127.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM88009
Similarity: 0.7444
Similarity to MM88009
| Tanimoto metric | 0.7444 |
|---|---|
| Cosine metric | 0.8544 |
| Dice metric | 0.8535 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+467 more
