Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM152592
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM152592 |
| SMILES |
CC(C)NCCOC=O
|
| InChIKey |
OBFQXUZRTFIZCC-UHFFFAOYSA-N
|
| MW [Da] |
131.18
Automatically obtained from RDkit software. |
| LogP |
0.16
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM66167
Similarity: 0.807
Similarity to MM66167
| Tanimoto metric | 0.807 |
|---|---|
| Cosine metric | 0.8983 |
| Dice metric | 0.8932 |
| MW: | 117.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM212990
Similarity: 0.7541
Similarity to MM212990
| Tanimoto metric | 0.7541 |
|---|---|
| Cosine metric | 0.8617 |
| Dice metric | 0.8598 |
| MW: | 133.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM235699
Similarity: 0.7403
Similarity to MM235699
| Tanimoto metric | 0.7403 |
|---|---|
| Cosine metric | 0.8604 |
| Dice metric | 0.8507 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+81 more
