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DocumentationIdentifier: MM261927
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM261927 |
| SMILES |
CCNC(C)CC(=O)CO
|
| InChIKey |
GIIGNJNJAONSFH-UHFFFAOYSA-N
|
| MW [Da] |
145.2
Automatically obtained from RDkit software. |
| LogP |
-0.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM61800
Similarity: 0.6977
Similarity to MM61800
| Tanimoto metric | 0.6977 |
|---|---|
| Cosine metric | 0.8234 |
| Dice metric | 0.8219 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM78080
Similarity: 0.6809
Similarity to MM78080
| Tanimoto metric | 0.6809 |
|---|---|
| Cosine metric | 0.8103 |
| Dice metric | 0.8101 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328523
Similarity: 0.6809
Similarity to MM328523
| Tanimoto metric | 0.6809 |
|---|---|
| Cosine metric | 0.8103 |
| Dice metric | 0.8101 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+131 more
