Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM346476
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM346476 |
| SMILES |
C#CCC(C)CCO
|
| InChIKey |
YEZSJZJAVVOCRN-UHFFFAOYSA-N
|
| MW [Da] |
112.17
Automatically obtained from RDkit software. |
| LogP |
1.03
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM344492
Similarity: 0.902
Similarity to MM344492
| Tanimoto metric | 0.902 |
|---|---|
| Cosine metric | 0.9497 |
| Dice metric | 0.9485 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM346122
Similarity: 0.7797
Similarity to MM346122
| Tanimoto metric | 0.7797 |
|---|---|
| Cosine metric | 0.883 |
| Dice metric | 0.8762 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM156030
Similarity: 0.7541
Similarity to MM156030
| Tanimoto metric | 0.7541 |
|---|---|
| Cosine metric | 0.8684 |
| Dice metric | 0.8598 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+655 more
