Common name
pyridine
IUPAC name
pyridine
SMILES
c1cccnc1
Common name
pyridine
IUPAC name
pyridine
SMILES
c1cccnc1
INCHI
InChI=1S/C5H5N/c1-2-4-6-5-3-1/h1-5H
FORMULA
C5H5N
Common name
pyridine
IUPAC name
pyridine
Molecular weight
79.100
clogP
1.626
clogS
-1.146
Frequency
0.0333
HBond Acceptor
1
HBond Donor
0
Total PolarSurface Area
12.89
Number of Rings
1
Rotatable Bond
0
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD01852 | nornicotine |
|
Insecticide | Insecticide |
| FDBD01990 | pyriproxyfen |
|
Insecticide | Insecticide |
| FDBD02232 | pyriprole |
|
Insecticide | Insecticide |
| FDBD02265 | fenpirithrin |
|
Insecticide | Insecticide |
| FDBD02314 | sulfoxaflor |
|
Insecticide | Insecticide |
| FDBD02323 | afidopyropen |
|
Insecticide | Insecticide |
| FDBD02345 | pyridalyl |
|
Insecticide | Insecticide |
| FDBD02346 | pyrifluquinazon |
|
Insecticide | Insecticide |
| FDBD02386 | diflufenican |
|
Herbicide | Herbicide |
| FDBD02391 | flufenican |
|
Herbicide | Herbicide |
97 ,
10
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 5ct7_ligand_frag_2.mol2 | 5ct7 | 1 | -6.29 | c1cccnc1 | 6 |
| 1t46_ligand_frag_0.mol2 | 1t46 | 1 | -6.28 | c1cccnc1 | 6 |
| 1xur_ligand_frag_3.mol2 | 1xur | 1 | -6.28 | c1cccnc1 | 6 |
| 3fu0_ligand_frag_2.mol2 | 3fu0 | 1 | -6.28 | c1ccncc1 | 6 |
| 3hng_ligand_frag_5.mol2 | 3hng | 1 | -6.28 | c1ccncc1 | 6 |
| 4yve_ligand_frag_4.mol2 | 4yve | 1 | -6.28 | c1ccncc1 | 6 |
| 2qu5_ligand_frag_0.mol2 | 2qu5 | 1 | -6.27 | c1cnccc1 | 6 |
645 ,
65
