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DocumentationIdentifier: MM235204
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM235204 |
| SMILES |
CC(C)(NCCO)C(=N)N
|
| InChIKey |
MCMWUBTVWPEXRL-UHFFFAOYSA-N
|
| MW [Da] |
145.21
Automatically obtained from RDkit software. |
| LogP |
-0.72
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162176
Similarity: 0.7583
Similarity to MM162176
| Tanimoto metric | 0.7583 |
|---|---|
| Cosine metric | 0.8708 |
| Dice metric | 0.8626 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM235203
Similarity: 0.7348
Similarity to MM235203
| Tanimoto metric | 0.7348 |
|---|---|
| Cosine metric | 0.8481 |
| Dice metric | 0.8472 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM235267
Similarity: 0.6761
Similarity to MM235267
| Tanimoto metric | 0.6761 |
|---|---|
| Cosine metric | 0.8068 |
| Dice metric | 0.8067 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+112 more
