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DocumentationIdentifier: MM275014
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM275014 |
| SMILES |
CC(C)C(CN)CC(N)=O
|
| InChIKey |
SLTBRQQHUDCNSQ-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
0.09
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM149885
Similarity: 0.7938
Similarity to MM149885
| Tanimoto metric | 0.7938 |
|---|---|
| Cosine metric | 0.891 |
| Dice metric | 0.8851 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM81352
Similarity: 0.7586
Similarity to MM81352
| Tanimoto metric | 0.7586 |
|---|---|
| Cosine metric | 0.8638 |
| Dice metric | 0.8627 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM268431
Similarity: 0.7477
Similarity to MM268431
| Tanimoto metric | 0.7477 |
|---|---|
| Cosine metric | 0.8562 |
| Dice metric | 0.8556 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+456 more
