Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM386241
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM386241 |
| SMILES |
CNCC=C(C#N)NC=O
|
| InChIKey |
DZGFWQXALYYQJX-UHFFFAOYSA-N
|
| MW [Da] |
139.16
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
MM159563
Similarity: 0.6818
Similarity to MM159563
| Tanimoto metric | 0.6818 |
|---|---|
| Cosine metric | 0.8257 |
| Dice metric | 0.8108 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM38119
Similarity: 0.6636
Similarity to MM38119
| Tanimoto metric | 0.6636 |
|---|---|
| Cosine metric | 0.8146 |
| Dice metric | 0.7978 |
| MW: | 110.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM274724
Similarity: 0.6333
Similarity to MM274724
| Tanimoto metric | 0.6333 |
|---|---|
| Cosine metric | 0.7796 |
| Dice metric | 0.7755 |
| MW: | 139.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+123 more
