Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM370581
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM370581 |
| SMILES |
C#CC#CCCC(C)C#N
|
| InChIKey |
QXXLANQPSLBPPF-UHFFFAOYSA-N
|
| MW [Da] |
131.18
Automatically obtained from RDkit software. |
| LogP |
1.56
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM167665
Similarity: 0.8507
Similarity to MM167665
| Tanimoto metric | 0.8507 |
|---|---|
| Cosine metric | 0.9224 |
| Dice metric | 0.9194 |
| MW: | 121.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM370416
Similarity: 0.8261
Similarity to MM370416
| Tanimoto metric | 0.8261 |
|---|---|
| Cosine metric | 0.9066 |
| Dice metric | 0.9048 |
| MW: | 135.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM370519
Similarity: 0.76
Similarity to MM370519
| Tanimoto metric | 0.76 |
|---|---|
| Cosine metric | 0.8637 |
| Dice metric | 0.8636 |
| MW: | 132.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+519 more
