Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM303198
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM303198 |
| SMILES |
C#CCC(C)C(O)C(=O)O
|
| InChIKey |
GGXNMXRXXUBNRX-UHFFFAOYSA-N
|
| MW [Da] |
142.15
Automatically obtained from RDkit software. |
| LogP |
0.09
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM260321
Similarity: 0.7203
Similarity to MM260321
| Tanimoto metric | 0.7203 |
|---|---|
| Cosine metric | 0.8414 |
| Dice metric | 0.8374 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM303206
Similarity: 0.6667
Similarity to MM303206
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8014 |
| Dice metric | 0.8 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM47918
Similarity: 0.6444
Similarity to MM47918
| Tanimoto metric | 0.6444 |
|---|---|
| Cosine metric | 0.8028 |
| Dice metric | 0.7838 |
| MW: | 128.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+111 more
