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DocumentationIdentifier: MM360299
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM360299 |
| SMILES |
CC(=CCCO)CNC=N
|
| InChIKey |
CWPWUAIMWHJDKL-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.51
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM360297
Similarity: 0.7426
Similarity to MM360297
| Tanimoto metric | 0.7426 |
|---|---|
| Cosine metric | 0.8532 |
| Dice metric | 0.8523 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM238360
Similarity: 0.7075
Similarity to MM238360
| Tanimoto metric | 0.7075 |
|---|---|
| Cosine metric | 0.8288 |
| Dice metric | 0.8287 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM381243
Similarity: 0.6818
Similarity to MM381243
| Tanimoto metric | 0.6818 |
|---|---|
| Cosine metric | 0.8108 |
| Dice metric | 0.8108 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+316 more
