Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM388254
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM388254 |
| SMILES |
C=CC(CC=O)NC=NC
|
| InChIKey |
DQWKCUMEXUUJSC-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
0.38
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM406218
Similarity: 0.6923
Similarity to MM406218
| Tanimoto metric | 0.6923 |
|---|---|
| Cosine metric | 0.8209 |
| Dice metric | 0.8182 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM93271
Similarity: 0.6763
Similarity to MM93271
| Tanimoto metric | 0.6763 |
|---|---|
| Cosine metric | 0.8096 |
| Dice metric | 0.8069 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM388252
Similarity: 0.648
Similarity to MM388252
| Tanimoto metric | 0.648 |
|---|---|
| Cosine metric | 0.787 |
| Dice metric | 0.7864 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+186 more
