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DocumentationIdentifier: MM364545
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM364545 |
| SMILES |
CNC(=N)CCOCCO
|
| InChIKey |
MIJFHHNHMOCTGV-UHFFFAOYSA-N
|
| MW [Da] |
146.19
Automatically obtained from RDkit software. |
| LogP |
-0.42
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM364543
Similarity: 0.7917
Similarity to MM364543
| Tanimoto metric | 0.7917 |
|---|---|
| Cosine metric | 0.8838 |
| Dice metric | 0.8837 |
| MW: | 145.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM152650
Similarity: 0.7816
Similarity to MM152650
| Tanimoto metric | 0.7816 |
|---|---|
| Cosine metric | 0.8841 |
| Dice metric | 0.8774 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291773
Similarity: 0.7451
Similarity to MM291773
| Tanimoto metric | 0.7451 |
|---|---|
| Cosine metric | 0.8541 |
| Dice metric | 0.8539 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+496 more
