Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM405403
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM405403 |
| SMILES |
C#CC(C#C)CNC=NC
|
| InChIKey |
HZGQMYRKOJINJJ-UHFFFAOYSA-N
|
| MW [Da] |
134.18
Automatically obtained from RDkit software. |
| LogP |
0.12
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM167346
Similarity: 0.9054
Similarity to MM167346
| Tanimoto metric | 0.9054 |
|---|---|
| Cosine metric | 0.9515 |
| Dice metric | 0.9504 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM199401
Similarity: 0.8243
Similarity to MM199401
| Tanimoto metric | 0.8243 |
|---|---|
| Cosine metric | 0.9079 |
| Dice metric | 0.9037 |
| MW: | 120.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM368668
Similarity: 0.8171
Similarity to MM368668
| Tanimoto metric | 0.8171 |
|---|---|
| Cosine metric | 0.8993 |
| Dice metric | 0.8993 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+162 more
