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DocumentationIdentifier: MM304481
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM304481 |
| SMILES |
C=C(OC=CCN)C(C)N
|
| InChIKey |
WAUGYKIPEKMZJY-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.34
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162956
Similarity: 0.8824
Similarity to MM162956
| Tanimoto metric | 0.8824 |
|---|---|
| Cosine metric | 0.9393 |
| Dice metric | 0.9375 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM304711
Similarity: 0.7712
Similarity to MM304711
| Tanimoto metric | 0.7712 |
|---|---|
| Cosine metric | 0.8711 |
| Dice metric | 0.8708 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM304483
Similarity: 0.7627
Similarity to MM304483
| Tanimoto metric | 0.7627 |
|---|---|
| Cosine metric | 0.8655 |
| Dice metric | 0.8654 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+508 more
