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DocumentationIdentifier: MM364460
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM364460 |
| SMILES |
CCNCCCC(=N)NC
|
| InChIKey |
BGYLUDCDAATESO-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
0.57
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM291765
Similarity: 0.875
Similarity to MM291765
| Tanimoto metric | 0.875 |
|---|---|
| Cosine metric | 0.9341 |
| Dice metric | 0.9333 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM113007
Similarity: 0.7778
Similarity to MM113007
| Tanimoto metric | 0.7778 |
|---|---|
| Cosine metric | 0.8819 |
| Dice metric | 0.875 |
| MW: | 115.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM318688
Similarity: 0.775
Similarity to MM318688
| Tanimoto metric | 0.775 |
|---|---|
| Cosine metric | 0.8733 |
| Dice metric | 0.8732 |
| MW: | 142.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+623 more
