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DocumentationIdentifier: MM90395
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM90395 |
| SMILES |
C=C(CC)C(N)CC(C)N
|
| InChIKey |
ATAGGLAKBWLDGD-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
MM81938
Similarity: 0.8288
Similarity to MM81938
| Tanimoto metric | 0.8288 |
|---|---|
| Cosine metric | 0.9077 |
| Dice metric | 0.9064 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM133625
Similarity: 0.8131
Similarity to MM133625
| Tanimoto metric | 0.8131 |
|---|---|
| Cosine metric | 0.9017 |
| Dice metric | 0.8969 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM90987
Similarity: 0.7965
Similarity to MM90987
| Tanimoto metric | 0.7965 |
|---|---|
| Cosine metric | 0.888 |
| Dice metric | 0.8867 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+733 more
