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DocumentationIdentifier: MM89871
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM89871 |
| SMILES |
CC=CN(C)C(=N)CNC
|
| InChIKey |
WXAOBXMITJBEOW-UHFFFAOYSA-N
|
| MW [Da] |
141.22
Automatically obtained from RDkit software. |
| LogP |
0.65
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM173336
Similarity: 0.7807
Similarity to MM173336
| Tanimoto metric | 0.7807 |
|---|---|
| Cosine metric | 0.8836 |
| Dice metric | 0.8768 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM410475
Similarity: 0.7063
Similarity to MM410475
| Tanimoto metric | 0.7063 |
|---|---|
| Cosine metric | 0.8294 |
| Dice metric | 0.8279 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM356326
Similarity: 0.6934
Similarity to MM356326
| Tanimoto metric | 0.6934 |
|---|---|
| Cosine metric | 0.8191 |
| Dice metric | 0.819 |
| MW: | 137.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | |||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+335 more
