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DocumentationIdentifier: MM37905
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM37905 |
| SMILES |
C=C(CN)NC(=O)CCC
|
| InChIKey |
VZFMLPNPCPRQLB-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.38
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM135521
Similarity: 0.7661
Similarity to MM135521
| Tanimoto metric | 0.7661 |
|---|---|
| Cosine metric | 0.8753 |
| Dice metric | 0.8676 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM236902
Similarity: 0.7313
Similarity to MM236902
| Tanimoto metric | 0.7313 |
|---|---|
| Cosine metric | 0.8468 |
| Dice metric | 0.8448 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM263132
Similarity: 0.7063
Similarity to MM263132
| Tanimoto metric | 0.7063 |
|---|---|
| Cosine metric | 0.828 |
| Dice metric | 0.8279 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+481 more
