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DocumentationIdentifier: MM263139
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM263139 |
| SMILES |
C=C(COC)NC(=N)CN
|
| InChIKey |
BNJMRUCROJWUHC-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
-0.33
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM263140
Similarity: 0.66
Similarity to MM263140
| Tanimoto metric | 0.66 |
|---|---|
| Cosine metric | 0.7957 |
| Dice metric | 0.7952 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM333388
Similarity: 0.6463
Similarity to MM333388
| Tanimoto metric | 0.6463 |
|---|---|
| Cosine metric | 0.786 |
| Dice metric | 0.7852 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.93 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM333302
Similarity: 0.6303
Similarity to MM333302
| Tanimoto metric | 0.6303 |
|---|---|
| Cosine metric | 0.7739 |
| Dice metric | 0.7732 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+388 more
