
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

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 |
![]() |
C(=O)N | 0.1240 |
FDBF00004 | acetic acid |
![]() |
CC(=O)O | 0.0687 |
FDBF00005 | benzene |
![]() |
c1ccccc1 | 0.2824 |
FDBF00007 | propane |
![]() |
C(C)C | 0.2412 |
FDBF00027 | N-methylacetamide |
![]() |
N(C(=O)C)C | 0.0175 |
FDBF00181 | 2-[formyl(methyl)amino]acetic acid |
![]() |
CN(CC(=O)O)C=O | 0.0003 |
FDBF00182 | N-benzylformamide |
![]() |
c1(ccccc1)CNC=O | 0.0038 |
FDBF00183 | 2-[acetyl(methyl)amino]acetic acid |
![]() |
CC(=O)N(C)CC(=O)O | 0.0003 |
FDBF00185 | pentanamide |
![]() |
C(CC(=O)N)CC | 0.0024 |
FDBF00188 | tetrazole |
![]() |
[nH]1nnnc1 | 0.0055 |