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DocumentationIdentifier: MM133758
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM133758 |
| SMILES |
CC(=N)N(C)CC(N)=O
|
| InChIKey |
ZPZRAHQFMLMQJY-UHFFFAOYSA-N
|
| MW [Da] |
129.16
Automatically obtained from RDkit software. |
| LogP |
-0.6
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM268898
Similarity: 0.8016
Similarity to MM268898
| Tanimoto metric | 0.8016 |
|---|---|
| Cosine metric | 0.8953 |
| Dice metric | 0.8899 |
| MW: | 144.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM150074
Similarity: 0.7453
Similarity to MM150074
| Tanimoto metric | 0.7453 |
|---|---|
| Cosine metric | 0.8577 |
| Dice metric | 0.8541 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM268899
Similarity: 0.7214
Similarity to MM268899
| Tanimoto metric | 0.7214 |
|---|---|
| Cosine metric | 0.8494 |
| Dice metric | 0.8382 |
| MW: | 145.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+27 more
