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DocumentationIdentifier: MM372394
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM372394 |
| SMILES |
CC1(CN)CN1CCCN
|
| InChIKey |
GZGXMCXAYNHYHO-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
-0.63
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM176831
Similarity: 0.95
Similarity to MM176831
| Tanimoto metric | 0.95 |
|---|---|
| Cosine metric | 0.9747 |
| Dice metric | 0.9744 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM372392
Similarity: 0.8581
Similarity to MM372392
| Tanimoto metric | 0.8581 |
|---|---|
| Cosine metric | 0.924 |
| Dice metric | 0.9236 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM372396
Similarity: 0.816
Similarity to MM372396
| Tanimoto metric | 0.816 |
|---|---|
| Cosine metric | 0.9 |
| Dice metric | 0.8986 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+272 more
