Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM98431
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM98431 |
| SMILES |
CC(O)C(O)C=O
|
| InChIKey |
DFFAMJFPVBTTBX-UHFFFAOYSA-N
|
| MW [Da] |
104.11
Automatically obtained from RDkit software. |
| LogP |
-1.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM111651
Similarity: 0.88
Similarity to MM111651
| Tanimoto metric | 0.88 |
|---|---|
| Cosine metric | 0.9381 |
| Dice metric | 0.9362 |
| MW: | 118.09 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM111565
Similarity: 0.7097
Similarity to MM111565
| Tanimoto metric | 0.7097 |
|---|---|
| Cosine metric | 0.8424 |
| Dice metric | 0.8302 |
| MW: | 120.1 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM97974
Similarity: 0.7083
Similarity to MM97974
| Tanimoto metric | 0.7083 |
|---|---|
| Cosine metric | 0.8315 |
| Dice metric | 0.8293 |
| MW: | 102.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+491 more
