Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM23773
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM23773 |
| SMILES |
CN(C=O)C(C#N)C=CF
|
| InChIKey |
RPPQUIWZPPWRDL-UHFFFAOYSA-N
|
| MW [Da] |
142.13
Automatically obtained from RDkit software. |
| LogP |
0.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM197116
Similarity: 0.7638
Similarity to MM197116
| Tanimoto metric | 0.7638 |
|---|---|
| Cosine metric | 0.8739 |
| Dice metric | 0.8661 |
| MW: | 124.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM51395
Similarity: 0.7402
Similarity to MM51395
| Tanimoto metric | 0.7402 |
|---|---|
| Cosine metric | 0.8603 |
| Dice metric | 0.8507 |
| MW: | 128.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM24835
Similarity: 0.6929
Similarity to MM24835
| Tanimoto metric | 0.6929 |
|---|---|
| Cosine metric | 0.8324 |
| Dice metric | 0.8186 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+64 more
