Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM349552
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM349552 |
| SMILES |
COC(=O)C(O)C(C)C=O
|
| InChIKey |
KBXSSSFUQAICRM-UHFFFAOYSA-N
|
| MW [Da] |
146.14
Automatically obtained from RDkit software. |
| LogP |
-0.64
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM319387
Similarity: 0.7286
Similarity to MM319387
| Tanimoto metric | 0.7286 |
|---|---|
| Cosine metric | 0.8536 |
| Dice metric | 0.843 |
| MW: | 132.12 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM50122
Similarity: 0.7071
Similarity to MM50122
| Tanimoto metric | 0.7071 |
|---|---|
| Cosine metric | 0.8409 |
| Dice metric | 0.8285 |
| MW: | 132.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM223809
Similarity: 0.6541
Similarity to MM223809
| Tanimoto metric | 0.6541 |
|---|---|
| Cosine metric | 0.7925 |
| Dice metric | 0.7909 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+211 more
