Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM452836
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM452836 |
| SMILES |
N=CNC=COC=CCN
|
| InChIKey |
FQCWEBWWMHAHCH-UHFFFAOYSA-N
|
| MW [Da] |
141.17
Automatically obtained from RDkit software. |
| LogP |
0.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM215367
Similarity: 0.831
Similarity to MM215367
| Tanimoto metric | 0.831 |
|---|---|
| Cosine metric | 0.9116 |
| Dice metric | 0.9077 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM452831
Similarity: 0.7284
Similarity to MM452831
| Tanimoto metric | 0.7284 |
|---|---|
| Cosine metric | 0.8429 |
| Dice metric | 0.8429 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM91580
Similarity: 0.7229
Similarity to MM91580
| Tanimoto metric | 0.7229 |
|---|---|
| Cosine metric | 0.8392 |
| Dice metric | 0.8392 |
| MW: | 136.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+196 more
