Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM292640
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM292640 |
| SMILES |
N#CCC(O)C(O)CCO
|
| InChIKey |
BRTUXWIOESVXJK-UHFFFAOYSA-N
|
| MW [Da] |
145.16
Automatically obtained from RDkit software. |
| LogP |
-1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM171932
Similarity: 0.7528
Similarity to MM171932
| Tanimoto metric | 0.7528 |
|---|---|
| Cosine metric | 0.8676 |
| Dice metric | 0.859 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM292719
Similarity: 0.7363
Similarity to MM292719
| Tanimoto metric | 0.7363 |
|---|---|
| Cosine metric | 0.855 |
| Dice metric | 0.8481 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM261354
Similarity: 0.7087
Similarity to MM261354
| Tanimoto metric | 0.7087 |
|---|---|
| Cosine metric | 0.8296 |
| Dice metric | 0.8295 |
| MW: | 145.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+381 more
