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DocumentationIdentifier: MM93929
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM93929 |
| SMILES |
C=C(C)C(N)CCNCC
|
| InChIKey |
CCHLVARGZKXZDI-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
0.89
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM92152
Similarity: 0.8526
Similarity to MM92152
| Tanimoto metric | 0.8526 |
|---|---|
| Cosine metric | 0.9234 |
| Dice metric | 0.9205 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM76287
Similarity: 0.7297
Similarity to MM76287
| Tanimoto metric | 0.7297 |
|---|---|
| Cosine metric | 0.8438 |
| Dice metric | 0.8438 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM301681
Similarity: 0.7105
Similarity to MM301681
| Tanimoto metric | 0.7105 |
|---|---|
| Cosine metric | 0.831 |
| Dice metric | 0.8308 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+490 more
