Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM313806
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM313806 |
| SMILES |
C=CC(CO)CCC(N)=O
|
| InChIKey |
AVOUTBYLEGGNFB-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
0.05
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM335848
Similarity: 0.7075
Similarity to MM335848
| Tanimoto metric | 0.7075 |
|---|---|
| Cosine metric | 0.8412 |
| Dice metric | 0.8287 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM85770
Similarity: 0.6792
Similarity to MM85770
| Tanimoto metric | 0.6792 |
|---|---|
| Cosine metric | 0.8242 |
| Dice metric | 0.809 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM331666
Similarity: 0.6579
Similarity to MM331666
| Tanimoto metric | 0.6579 |
|---|---|
| Cosine metric | 0.7996 |
| Dice metric | 0.7937 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+328 more
