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DocumentationIdentifier: MM393358
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM393358 |
| SMILES |
C=C(C)N(C=O)CCNC
|
| InChIKey |
WCDCSNWRDBYGPY-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.2
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM404156
Similarity: 0.681
Similarity to MM404156
| Tanimoto metric | 0.681 |
|---|---|
| Cosine metric | 0.8181 |
| Dice metric | 0.8103 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM199207
Similarity: 0.6486
Similarity to MM199207
| Tanimoto metric | 0.6486 |
|---|---|
| Cosine metric | 0.8054 |
| Dice metric | 0.7869 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM307035
Similarity: 0.6284
Similarity to MM307035
| Tanimoto metric | 0.6284 |
|---|---|
| Cosine metric | 0.7742 |
| Dice metric | 0.7718 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+223 more
