Responsive image

Common name


Valsartan

IUPAC name


(2S)-3-methyl-2-[N-({4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl}methyl)pentanamido]butanoic acid

SMILES


CCCCC(=O)N(CC1=CC=C(C=C1)C1=CC=CC=C1C1=NNN=N1)[C@@H](C(C)C)C(O)=O

Compound class


Antihypertensive Agents; Angiotensin II Type 1 Receptor Blockers; Angiotensin Receptor Antagonists; Lipid Modifying Agents; Cardiovascular System; Angiotensin II Antagonists, Plain; Agents Acting on the Renin-Angiotensin System; Angiotensin II Antagonists and Diuretics; Angiotensin II Antagonists and Calcium Channel Blockers; Cytochrome P-450 CYP2C9 Inhibitors; Cytochrome P-450 CYP2C9 Inducers; Angiotensin II Receptor Antagonists;

Therapeutic area


May be used as a first line agent to treat uncomplicated hypertension, isolated systolic hypertension and left ventricular hypertrophy. May be used as a first line agent to delay progression of diabetic nephropathy. Losartan may be also used as a second line agent in the treatment of congestive heart failure, systolic dysfunction, myocardial infarction and coronary artery disease in those intolerant of ACE inhibitors.

Common name


Valsartan

IUPAC name


(2S)-3-methyl-2-[N-({4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl}methyl)pentanamido]butanoic acid

SMILES


CCCCC(=O)N(CC1=CC=C(C=C1)C1=CC=CC=C1C1=NNN=N1)[C@@H](C(C)C)C(O)=O

INCHI


InChI=1S/C24H29N5O3/c1-4-5-10-21(30)29(22(16(2)3)24(31)32)15-17-11-13-18(14-12-17)19-8-6-7-9-20(19)23-25-27-28-26-23/h6-9,11-14,16,22H,4-5,10,15H2,1-3H3,(H,31,32)(H,25,26,27,28)/t22-/m0/s1

FORMULA


C24H29N5O3

Responsive image

Common name


Valsartan

IUPAC name


(2S)-3-methyl-2-[N-({4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl}methyl)pentanamido]butanoic acid

Molecular weight


435.519

clogP


4.209

clogS


-5.740

HBond Acceptor


6

HBond Donor


2

Total Polar
Surface Area


112.07

Number of Rings


3

Rotatable Bond


11

Drug ID Common name Structure CAS SMILE Frequency
FDBF00003 formamide Responsive image C(=O)N 0.1240
FDBF00004 acetic acid Responsive image CC(=O)O 0.0687
FDBF00005 benzene Responsive image c1ccccc1 0.2824
FDBF00007 propane Responsive image C(C)C 0.2412
FDBF00027 N-methylacetamide Responsive image N(C(=O)C)C 0.0175
FDBF00181 2-[formyl(methyl)amino]acetic acid Responsive image CN(CC(=O)O)C=O 0.0003
FDBF00182 N-benzylformamide Responsive image c1(ccccc1)CNC=O 0.0038
FDBF00183 2-[acetyl(methyl)amino]acetic acid Responsive image CC(=O)N(C)CC(=O)O 0.0003
FDBF00185 pentanamide Responsive image C(CC(=O)N)CC 0.0024
FDBF00188 tetrazole Responsive image [nH]1nnnc1 0.0055
20 , 3