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DocumentationIdentifier: MM364543
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM364543 |
| SMILES |
CNC(=N)CCOCCN
|
| InChIKey |
FNNCPKZONCPYPU-UHFFFAOYSA-N
|
| MW [Da] |
145.21
Automatically obtained from RDkit software. |
| LogP |
-0.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM364545
Similarity: 0.7917
Similarity to MM364545
| Tanimoto metric | 0.7917 |
|---|---|
| Cosine metric | 0.8838 |
| Dice metric | 0.8837 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM152649
Similarity: 0.7765
Similarity to MM152649
| Tanimoto metric | 0.7765 |
|---|---|
| Cosine metric | 0.8812 |
| Dice metric | 0.8742 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291773
Similarity: 0.76
Similarity to MM291773
| Tanimoto metric | 0.76 |
|---|---|
| Cosine metric | 0.8641 |
| Dice metric | 0.8636 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+496 more
