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DocumentationIdentifier: MM396612
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM396612 |
| SMILES |
CCC(=NCCO)N(C)C
|
| InChIKey |
CVEQOYRTQMKPCT-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
0.35
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM410785
Similarity: 0.7109
Similarity to MM410785
| Tanimoto metric | 0.7109 |
|---|---|
| Cosine metric | 0.8315 |
| Dice metric | 0.8311 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM306198
Similarity: 0.6642
Similarity to MM306198
| Tanimoto metric | 0.6642 |
|---|---|
| Cosine metric | 0.7983 |
| Dice metric | 0.7982 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM385687
Similarity: 0.6522
Similarity to MM385687
| Tanimoto metric | 0.6522 |
|---|---|
| Cosine metric | 0.7895 |
| Dice metric | 0.7895 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+302 more
