Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM388568
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM388568 |
| SMILES |
CC=CC(CCCN)NC
|
| InChIKey |
SHZGIBPFRWADPP-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
0.89
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM178148
Similarity: 0.8333
Similarity to MM178148
| Tanimoto metric | 0.8333 |
|---|---|
| Cosine metric | 0.9129 |
| Dice metric | 0.9091 |
| MW: | 127.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM94403
Similarity: 0.7708
Similarity to MM94403
| Tanimoto metric | 0.7708 |
|---|---|
| Cosine metric | 0.878 |
| Dice metric | 0.8706 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM88248
Similarity: 0.7115
Similarity to MM88248
| Tanimoto metric | 0.7115 |
|---|---|
| Cosine metric | 0.834 |
| Dice metric | 0.8315 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+886 more
