Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM250863
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM250863 |
| SMILES |
CC(C)CCC(=O)CCO
|
| InChIKey |
CGKICHLZJBAZAS-UHFFFAOYSA-N
|
| MW [Da] |
144.21
Automatically obtained from RDkit software. |
| LogP |
1.37
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM156085
Similarity: 0.8143
Similarity to MM156085
| Tanimoto metric | 0.8143 |
|---|---|
| Cosine metric | 0.9024 |
| Dice metric | 0.8976 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291722
Similarity: 0.7703
Similarity to MM291722
| Tanimoto metric | 0.7703 |
|---|---|
| Cosine metric | 0.8723 |
| Dice metric | 0.8702 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM353585
Similarity: 0.75
Similarity to MM353585
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.8581 |
| Dice metric | 0.8571 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+496 more
