Common name
N-propylacetamide
IUPAC name
N-propylacetamide
SMILES
C(CC)NC(=O)C
Common name
N-propylacetamide
IUPAC name
N-propylacetamide
SMILES
C(CC)NC(=O)C
INCHI
InChI=1S/C5H11NO/c1-3-4-6-5(2)7/h3-4H2,1-2H3,(H,6,7)
FORMULA
C5H11NO
Common name
N-propylacetamide
IUPAC name
N-propylacetamide
Molecular weight
101.147
clogP
0.351
clogS
-1.387
Frequency
0.0014
HBond Acceptor
1
HBond Donor
1
Total PolarSurface Area
29.1
Number of Rings
0
Rotatable Bond
2
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD00524 | Acamprosate |
|
Alcohol Deterrents; Nervous System; Drugs Used in Addictive Disorders; Drugs Used in Alcohol Dependence; | For the maintenance of abstinence from alcohol in patients with alcohol dependence who are abstinent at treatment initiation. |
| FDBD00753 | Benzylpenicilloyl Polylysine |
|
Acetamides; | For use as a adjunct in assessing the risk of administering penicillin (benzylpenicillin or penicillin G). |
| FDBD01652 | Cobicistat |
|
Anti-HIV Agents; Antiinfectives for Systemic Use; Direct Acting Antivirals; Antivirals for Systemic Use; Cytochrome P-450 CYP3A Inhibitors; CYP2D6 Inducers; CYP2D6 Inducers (strong); | Cobicistat is a CYP3A inhibitor indicated to increase systemic exposure of atazanavir or darunavir (once daily dosing regimen) in combination with other antiretroviral agents in the treatment of HIV-1 infection. It is not interchangeable with ritonavir to increase systemic exposure of darunavir 600 mg twice daily, fosamprenavir, saquinavir, or tipranavir due to lack of exposure data. The use of cobicistat is not recommended with darunavir 600 mg twice daily, fosamprenavir, saquinavir or tipranavir. Complex or unknown mechanisms of drug interactions preclude extrapolation of ritonavir drug interactions to certain cobicistat interactions. Cobicistat and ritonavir when administered with either atazanavir or darunavir may result in different drug interactions when used with concomitant medications. |
| FDBD02216 | phosglycin |
|
Insecticide | Insecticide |
4 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1oth_ligand_4_10.mol2 | 1oth | 1 | -6.58 | CCCNC(=O)C | 7 |
| 1tcw_ligand_3_274.mol2 | 1tcw | 1 | -6.38 | C(NC(=O)C)C(C)C | 8 |
| 4bzn_ligand_3_0.mol2 | 4bzn | 1 | -6.37 | C(C)(C)(C)CNC(=O)C | 9 |
| 5hvp_ligand_3_170.mol2 | 5hvp | 1 | -6.35 | CC(=O)NCC(C)C | 8 |
| 3hy7_ligand_3_0.mol2 | 3hy7 | 1 | -6.34 | N(C(=O)C)CC(C)(C)C | 9 |
| 1a7c_ligand_3_145.mol2 | 1a7c | 1 | -6.33 | CC(=O)NCC(C)C | 8 |
| 1bdl_ligand_3_279.mol2 | 1bdl | 1 | -6.33 | C(NC(=O)C)C(C)C | 8 |
| 1ec1_ligand_3_813.mol2 | 1ec1 | 1 | -6.32 | CC(=O)NCC(C)C | 8 |
381 ,
39
