Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM203000
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM203000 |
| SMILES |
N=CNCC1(CN)CN1
|
| InChIKey |
CCIOCQQXVRUFJT-UHFFFAOYSA-N
|
| MW [Da] |
128.18
Automatically obtained from RDkit software. |
| LogP |
-1.52
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM429613
Similarity: 0.873
Similarity to MM429613
| Tanimoto metric | 0.873 |
|---|---|
| Cosine metric | 0.9344 |
| Dice metric | 0.9322 |
| MW: | 142.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM115763
Similarity: 0.8273
Similarity to MM115763
| Tanimoto metric | 0.8273 |
|---|---|
| Cosine metric | 0.9095 |
| Dice metric | 0.9055 |
| MW: | 113.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM176305
Similarity: 0.7302
Similarity to MM176305
| Tanimoto metric | 0.7302 |
|---|---|
| Cosine metric | 0.8441 |
| Dice metric | 0.844 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+130 more
