Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM89245
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM89245 |
| SMILES |
CN(C=N)CC(F)=CC#N
|
| InChIKey |
AEQQXQRYVOWWOV-UHFFFAOYSA-N
|
| MW [Da] |
141.15
Automatically obtained from RDkit software. |
| LogP |
0.9
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM142999
Similarity: 0.7876
Similarity to MM142999
| Tanimoto metric | 0.7876 |
|---|---|
| Cosine metric | 0.8875 |
| Dice metric | 0.8812 |
| MW: | 130.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM88912
Similarity: 0.7699
Similarity to MM88912
| Tanimoto metric | 0.7699 |
|---|---|
| Cosine metric | 0.8774 |
| Dice metric | 0.87 |
| MW: | 127.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM265618
Similarity: 0.6692
Similarity to MM265618
| Tanimoto metric | 0.6692 |
|---|---|
| Cosine metric | 0.8019 |
| Dice metric | 0.8018 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+91 more
