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DocumentationIdentifier: MM363409
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM363409 |
| SMILES |
C=COCCNC(C)CN
|
| InChIKey |
YZUPNJXDGVGSQV-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
0.08
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM73512
Similarity: 0.759
Similarity to MM73512
| Tanimoto metric | 0.759 |
|---|---|
| Cosine metric | 0.8633 |
| Dice metric | 0.863 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM212988
Similarity: 0.7333
Similarity to MM212988
| Tanimoto metric | 0.7333 |
|---|---|
| Cosine metric | 0.8563 |
| Dice metric | 0.8462 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291196
Similarity: 0.7079
Similarity to MM291196
| Tanimoto metric | 0.7079 |
|---|---|
| Cosine metric | 0.829 |
| Dice metric | 0.8289 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+531 more
