Common name
2,2-diphenylacetamide
IUPAC name
2,2-diphenylacetamide
SMILES
c1(ccccc1)C(c2ccccc2)C(=O)N
Common name
2,2-diphenylacetamide
IUPAC name
2,2-diphenylacetamide
SMILES
c1(ccccc1)C(c2ccccc2)C(=O)N
INCHI
InChI=1S/C14H13NO/c15-14(16)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H,(H2,15,16)
FORMULA
C14H13NO
Common name
2,2-diphenylacetamide
IUPAC name
2,2-diphenylacetamide
Molecular weight
211.259
clogP
2.729
clogS
-3.045
Frequency
0.0010
HBond Acceptor
1
HBond Donor
2
Total PolarSurface Area
43.09
Number of Rings
2
Rotatable Bond
3
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD00369 | Darifenacin |
|
Muscarinic Antagonists; Antispasmodic Agents; Genito Urinary System and Sex Hormones; Drugs for Urinary Frequency and Incontinence; Urological Agents; CYP2D6 Inducers; CYP2D6 Inducers (strong); CYP3A4 Inhibitors; | For the treatment of overactive bladder with symptoms of urge urinary incontinence, urgency and frequency. |
| FDBD01274 | Isopropamide |
|
Alimentary Tract and Metabolism; Drugs for Functional Gastrointestinal Disorders; Synthetic Anticholinergics, Quaternary Ammonium Compounds; | For the treatment of a wide range of gastrointestinal disorders, including such conditions as peptic ulcer, gastritis, hyperchlorhydria, functional diarrhea, irritable or spastic colon, pyloroduodenal irritability, pylorospasm, acute nonspecific gastroenteritis, biliary dyskinesia and chronic cholelithiasis, duodenitis, gastrointestinal spasm; it may also be used to treat genitourinary spasm. |
| FDBD01768 | Imidafenacin |
|
; |
3 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1gmy_ligand_3_83.mol2 | 1gmy | 1 | -6.43 | c1cc(ccc1)C(C(=O)N)c1ccccc1 | 16 |
| 3f7h_ligand_3_55.mol2 | 3f7h | 1 | -6.20 | c1(ccccc1)C(c1ccccc1)C(=O)N | 16 |
| 3ahn_ligand_2_0.mol2 | 3ahn | 0.882353 | -6.99 | c1(ccccc1)CC(=O)N | 10 |
| 1hte_ligand_2_20.mol2 | 1hte | 0.882353 | -6.71 | c1c(cccc1)CC(=O)N | 10 |
| 1htf_ligand_2_56.mol2 | 1htf | 0.882353 | -6.62 | c1ccccc1CC(=O)N | 10 |
| 1htg_ligand_2_54.mol2 | 1htg | 0.882353 | -6.62 | C(=O)(N)Cc1ccccc1 | 10 |
| 4kqq_ligand_2_14.mol2 | 4kqq | 0.882353 | -6.61 | c1(ccccc1)CC(=O)N | 10 |
| 4kqr_ligand_2_14.mol2 | 4kqr | 0.882353 | -6.56 | O=C(N)Cc1ccccc1 | 10 |
| 4kqo_ligand_2_14.mol2 | 4kqo | 0.882353 | -6.54 | c1(ccccc1)CC(=O)N | 10 |
188 ,
19
