Common name
nitrous acid
IUPAC name
nitrous acid
SMILES
ON=O
Common name
nitrous acid
IUPAC name
nitrous acid
SMILES
ON=O
INCHI
InChI=1S/HNO2/c2-1-3/h(H,2,3)
FORMULA
HNO2
Common name
nitrous acid
IUPAC name
nitrous acid
Molecular weight
47.013
clogP
-1.551
clogS
0.965
Frequency
0.0003
HBond Acceptor
3
HBond Donor
1
Total PolarSurface Area
49.66
Number of Rings
0
Rotatable Bond
0
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD01685 | Sodium Nitrite |
|
Indicators and Reagents; Antidotes; Food Preservatives; | For sequential use with sodium thiosulfate for the treatment of acute cyanide poisoning that is judged to be life-threatening. |
1 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 2on3_ligand_1_2.mol2 | 2on3 | 0.2 | -5.36 | CO[NH3+] | 3 |
| 2nv7_ligand_frag_2.mol2 | 2nv7 | 0.2 | -5.29 | C[NH2+]O | 3 |
| 3dz5_ligand_1_0.mol2 | 3dz5 | 0.2 | -5.23 | [NH3+]OC | 3 |
| 1i72_ligand_1_0.mol2 | 1i72 | 0.2 | -5.22 | CO[NH3+] | 3 |
| 2ooz_ligand_frag_1.mol2 | 2ooz | 0.2 | -5.17 | C=NO | 3 |
261 ,
27
