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DocumentationIdentifier: MM69830
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM69830 |
| SMILES |
CCC(=O)N(C)CCNC
|
| InChIKey |
AUCZYUIGCSQWJJ-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
MM172429
Similarity: 0.8558
Similarity to MM172429
| Tanimoto metric | 0.8558 |
|---|---|
| Cosine metric | 0.9251 |
| Dice metric | 0.9223 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM33160
Similarity: 0.7037
Similarity to MM33160
| Tanimoto metric | 0.7037 |
|---|---|
| Cosine metric | 0.8332 |
| Dice metric | 0.8261 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM292847
Similarity: 0.7008
Similarity to MM292847
| Tanimoto metric | 0.7008 |
|---|---|
| Cosine metric | 0.8246 |
| Dice metric | 0.8241 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+491 more
