Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM274986
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM274986 |
| SMILES |
CC(C)OC(C#N)C(C)O
|
| InChIKey |
VYLXKKUQJSBDPO-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
0.68
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM52175
Similarity: 0.8624
Similarity to MM52175
| Tanimoto metric | 0.8624 |
|---|---|
| Cosine metric | 0.9286 |
| Dice metric | 0.9261 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM392588
Similarity: 0.7805
Similarity to MM392588
| Tanimoto metric | 0.7805 |
|---|---|
| Cosine metric | 0.8767 |
| Dice metric | 0.8767 |
| MW: | 145.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM376491
Similarity: 0.752
Similarity to MM376491
| Tanimoto metric | 0.752 |
|---|---|
| Cosine metric | 0.8585 |
| Dice metric | 0.8584 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+343 more
