Common name
chloroform
IUPAC name
chloroform
SMILES
ClC(Cl)Cl
Common name
chloroform
IUPAC name
chloroform
SMILES
ClC(Cl)Cl
INCHI
InChI=1S/CHCl3/c2-1(3)4/h1H
FORMULA
CHCl3
Common name
chloroform
IUPAC name
chloroform
Molecular weight
119.378
clogP
2.593
clogS
-1.726
Frequency
0.0082
HBond Acceptor
0
HBond Donor
0
Total PolarSurface Area
0
Number of Rings
0
Rotatable Bond
0
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD01227 | Chloral hydrate |
|
Hypnotics and Sedatives; Nervous System; Psycholeptics; Aldehydes and Derivatives; | Mainly used as a hyponotic in the treatment of insomnia; however, it is only effective as a hypnotic for short-term use. May be used as a routine sedative preoperatively to decrease anxiety and cause sedation and/or sleep with respiration depression or cough reflex. |
| FDBD01578 | Amfecloral |
|
; | Used as an appetite suppressant. |
| FDBD01940 | chloroform |
|
Insecticide | Insecticide |
| FDBD02035 | bromo-DDT |
|
Insecticide | Insecticide |
| FDBD02036 | DDT |
|
Insecticide | Insecticide |
| FDBD02040 | methoxychlor |
|
Insecticide | Insecticide |
| FDBD02083 | chlorethoxyfos |
|
Insecticide | Insecticide |
| FDBD02195 | butonate |
|
Insecticide | Insecticide |
| FDBD02196 | trichlorfon |
|
Insecticide | Insecticide |
| FDBD02211 | chloramine phosphorus |
|
Insecticide | Insecticide |
24 ,
3
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 4yas_ligand_frag_0.mol2 | 4yas | 1 | -5.97 | C(Cl)(Cl)Cl | 4 |
| 4mgd_ligand_frag_2.mol2 | 4mgd | 1 | -5.90 | C(Cl)(Cl)Cl | 4 |
| 4zow_ligand_frag_0.mol2 | 4zow | 1 | -5.50 | C(Cl)Cl | 3 |
| 1ct8_ligand_frag_1.mol2 | 1ct8 | 1 | -5.48 | ClCCl | 3 |
| 4djo_ligand_frag_15.mol2 | 4djo | 1 | -5.34 | C(Cl)Cl | 3 |
| 4mgd_ligand_1_1.mol2 | 4mgd | 0.6 | -6.25 | CC(Cl)(Cl)Cl | 5 |
| 4o2p_ligand_1_7.mol2 | 4o2p | 0.4 | -5.63 | C(Cl)C | 3 |
| 5cqj_ligand_frag_1.mol2 | 5cqj | 0.4 | -5.44 | CCCl | 3 |
| 3f78_ligand_1_1.mol2 | 3f78 | 0.4 | -5.42 | OCCl | 3 |
| 1xa5_ligand_1_4.mol2 | 1xa5 | 0.4 | -5.33 | C(Cl)C | 3 |
640 ,
65
