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DocumentationIdentifier: MM73809
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM73809 |
| SMILES |
CCNCCC(=O)N(C)C
|
| InChIKey |
NEGDLSFFPNQBPZ-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
0.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM419193
Similarity: 0.8511
Similarity to MM419193
| Tanimoto metric | 0.8511 |
|---|---|
| Cosine metric | 0.9225 |
| Dice metric | 0.9195 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM316969
Similarity: 0.8022
Similarity to MM316969
| Tanimoto metric | 0.8022 |
|---|---|
| Cosine metric | 0.8905 |
| Dice metric | 0.8902 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM304753
Similarity: 0.7766
Similarity to MM304753
| Tanimoto metric | 0.7766 |
|---|---|
| Cosine metric | 0.875 |
| Dice metric | 0.8743 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+512 more
