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DocumentationIdentifier: MM308077
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM308077 |
| SMILES |
CNC(C)(CO)CNC=N
|
| InChIKey |
OSOMQHVKHNQUFG-UHFFFAOYSA-N
|
| MW [Da] |
145.21
Automatically obtained from RDkit software. |
| LogP |
-0.85
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM138226
Similarity: 0.7672
Similarity to MM138226
| Tanimoto metric | 0.7672 |
|---|---|
| Cosine metric | 0.8759 |
| Dice metric | 0.8683 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM240004
Similarity: 0.687
Similarity to MM240004
| Tanimoto metric | 0.687 |
|---|---|
| Cosine metric | 0.8155 |
| Dice metric | 0.8145 |
| MW: | 145.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM308011
Similarity: 0.6846
Similarity to MM308011
| Tanimoto metric | 0.6846 |
|---|---|
| Cosine metric | 0.8142 |
| Dice metric | 0.8128 |
| MW: | 147.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+110 more
