Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM229171
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM229171 |
| SMILES |
C=CC(C)(C#N)NC(C)C
|
| InChIKey |
ZFRZNPRFCRKXRV-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM139541
Similarity: 0.8922
Similarity to MM139541
| Tanimoto metric | 0.8922 |
|---|---|
| Cosine metric | 0.9445 |
| Dice metric | 0.943 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM309488
Similarity: 0.8378
Similarity to MM309488
| Tanimoto metric | 0.8378 |
|---|---|
| Cosine metric | 0.9118 |
| Dice metric | 0.9118 |
| MW: | 136.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM309493
Similarity: 0.8304
Similarity to MM309493
| Tanimoto metric | 0.8304 |
|---|---|
| Cosine metric | 0.9073 |
| Dice metric | 0.9073 |
| MW: | 135.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+388 more
