Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM166443
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM166443 |
| SMILES |
N=C(CN)NCCCN
|
| InChIKey |
QWLBEIIWVGCQFM-UHFFFAOYSA-N
|
| MW [Da] |
130.2
Automatically obtained from RDkit software. |
| LogP |
-1.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM364696
Similarity: 0.9189
Similarity to MM364696
| Tanimoto metric | 0.9189 |
|---|---|
| Cosine metric | 0.9586 |
| Dice metric | 0.9577 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM258457
Similarity: 0.7556
Similarity to MM258457
| Tanimoto metric | 0.7556 |
|---|---|
| Cosine metric | 0.8692 |
| Dice metric | 0.8608 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM144632
Similarity: 0.716
Similarity to MM144632
| Tanimoto metric | 0.716 |
|---|---|
| Cosine metric | 0.8347 |
| Dice metric | 0.8345 |
| MW: | 129.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+332 more
