Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM376013
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM376013 |
| SMILES |
CCCC#CCC(=N)NC
|
| InChIKey |
QXDJGSPLSCGZJD-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.38
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM169227
Similarity: 0.8734
Similarity to MM169227
| Tanimoto metric | 0.8734 |
|---|---|
| Cosine metric | 0.9346 |
| Dice metric | 0.9324 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM376132
Similarity: 0.7841
Similarity to MM376132
| Tanimoto metric | 0.7841 |
|---|---|
| Cosine metric | 0.879 |
| Dice metric | 0.879 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM153917
Similarity: 0.7722
Similarity to MM153917
| Tanimoto metric | 0.7722 |
|---|---|
| Cosine metric | 0.8787 |
| Dice metric | 0.8714 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+283 more
