Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM263391
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM263391 |
| SMILES |
C=CCC(=N)NC(=C)CC
|
| InChIKey |
KBPXNXOEIBPWRZ-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.05
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM135635
Similarity: 0.8276
Similarity to MM135635
| Tanimoto metric | 0.8276 |
|---|---|
| Cosine metric | 0.9097 |
| Dice metric | 0.9057 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM142581
Similarity: 0.8103
Similarity to MM142581
| Tanimoto metric | 0.8103 |
|---|---|
| Cosine metric | 0.9002 |
| Dice metric | 0.8952 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM263386
Similarity: 0.7846
Similarity to MM263386
| Tanimoto metric | 0.7846 |
|---|---|
| Cosine metric | 0.8793 |
| Dice metric | 0.8793 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+395 more
