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DocumentationIdentifier: MM293570
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM293570 |
| SMILES |
C=CCC(=O)N(C)CC=O
|
| InChIKey |
BFHODNMICDMXFT-UHFFFAOYSA-N
|
| MW [Da] |
141.17
Automatically obtained from RDkit software. |
| LogP |
0.22
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM173174
Similarity: 0.7719
Similarity to MM173174
| Tanimoto metric | 0.7719 |
|---|---|
| Cosine metric | 0.8786 |
| Dice metric | 0.8713 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM293572
Similarity: 0.7031
Similarity to MM293572
| Tanimoto metric | 0.7031 |
|---|---|
| Cosine metric | 0.8266 |
| Dice metric | 0.8257 |
| MW: | 143.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM353490
Similarity: 0.6846
Similarity to MM353490
| Tanimoto metric | 0.6846 |
|---|---|
| Cosine metric | 0.8135 |
| Dice metric | 0.8128 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+201 more
