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DocumentationIdentifier: MM93950
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM93950 |
| SMILES |
C=CN(C)C=NCCNC
|
| InChIKey |
DGSHEHRCIFOIIW-UHFFFAOYSA-N
|
| MW [Da] |
141.22
Automatically obtained from RDkit software. |
| LogP |
0.31
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM75700
Similarity: 0.7949
Similarity to MM75700
| Tanimoto metric | 0.7949 |
|---|---|
| Cosine metric | 0.8857 |
| Dice metric | 0.8857 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM214857
Similarity: 0.7714
Similarity to MM214857
| Tanimoto metric | 0.7714 |
|---|---|
| Cosine metric | 0.8783 |
| Dice metric | 0.871 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM287992
Similarity: 0.7632
Similarity to MM287992
| Tanimoto metric | 0.7632 |
|---|---|
| Cosine metric | 0.8665 |
| Dice metric | 0.8657 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+279 more
