Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM378017
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM378017 |
| SMILES |
N#CC=CN(C=N)CCO
|
| InChIKey |
CTVGGLFUTUFNCC-UHFFFAOYSA-N
|
| MW [Da] |
139.16
Automatically obtained from RDkit software. |
| LogP |
-0.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM377921
Similarity: 0.6967
Similarity to MM377921
| Tanimoto metric | 0.6967 |
|---|---|
| Cosine metric | 0.8215 |
| Dice metric | 0.8213 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM71957
Similarity: 0.6838
Similarity to MM71957
| Tanimoto metric | 0.6838 |
|---|---|
| Cosine metric | 0.8145 |
| Dice metric | 0.8122 |
| MW: | 139.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM378015
Similarity: 0.6667
Similarity to MM378015
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8 |
| Dice metric | 0.8 |
| MW: | 142.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+204 more
