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DocumentationIdentifier: MM389759
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM389759 |
| SMILES |
C=CC(C(=N)N)C(=O)CC
|
| InChIKey |
QWJMCNCCVRRSJM-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
0.7
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM160494
Similarity: 0.6707
Similarity to MM160494
| Tanimoto metric | 0.6707 |
|---|---|
| Cosine metric | 0.8189 |
| Dice metric | 0.8029 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM389761
Similarity: 0.5991
Similarity to MM389761
| Tanimoto metric | 0.5991 |
|---|---|
| Cosine metric | 0.7498 |
| Dice metric | 0.7493 |
| MW: | 142.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM297458
Similarity: 0.5787
Similarity to MM297458
| Tanimoto metric | 0.5787 |
|---|---|
| Cosine metric | 0.7351 |
| Dice metric | 0.7331 |
| MW: | 146.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+42 more
