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DocumentationIdentifier: MM363188
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM363188 |
| SMILES |
COC(C)CCCNC=N
|
| InChIKey |
HMOQGYBWPOLPMV-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM165504
Similarity: 0.8118
Similarity to MM165504
| Tanimoto metric | 0.8118 |
|---|---|
| Cosine metric | 0.901 |
| Dice metric | 0.8961 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402031
Similarity: 0.6832
Similarity to MM402031
| Tanimoto metric | 0.6832 |
|---|---|
| Cosine metric | 0.8118 |
| Dice metric | 0.8118 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM304746
Similarity: 0.6832
Similarity to MM304746
| Tanimoto metric | 0.6832 |
|---|---|
| Cosine metric | 0.8118 |
| Dice metric | 0.8118 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+513 more
