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DocumentationIdentifier: MM92939
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM92939 |
| SMILES |
C=C(C)CCNCC(C)N
|
| InChIKey |
JUOQKMKNAVLOTP-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
MM84488
Similarity: 0.8243
Similarity to MM84488
| Tanimoto metric | 0.8243 |
|---|---|
| Cosine metric | 0.9079 |
| Dice metric | 0.9037 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM363322
Similarity: 0.7654
Similarity to MM363322
| Tanimoto metric | 0.7654 |
|---|---|
| Cosine metric | 0.8677 |
| Dice metric | 0.8671 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM84620
Similarity: 0.7412
Similarity to MM84620
| Tanimoto metric | 0.7412 |
|---|---|
| Cosine metric | 0.8514 |
| Dice metric | 0.8514 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+553 more
