Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM409663
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM409663 |
| SMILES |
C#CC(C#N)CC#CCC
|
| InChIKey |
QZGAPHNLLSUODF-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
MM199729
Similarity: 0.8947
Similarity to MM199729
| Tanimoto metric | 0.8947 |
|---|---|
| Cosine metric | 0.9459 |
| Dice metric | 0.9444 |
| MW: | 117.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM380139
Similarity: 0.8182
Similarity to MM380139
| Tanimoto metric | 0.8182 |
|---|---|
| Cosine metric | 0.9011 |
| Dice metric | 0.9 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM409719
Similarity: 0.7727
Similarity to MM409719
| Tanimoto metric | 0.7727 |
|---|---|
| Cosine metric | 0.8721 |
| Dice metric | 0.8718 |
| MW: | 128.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+272 more
