Responsive image

Common name


Pitavastatin

IUPAC name


(3R,5S,6E)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3,5-dihydroxyhept-6-enoic acid

SMILES


O[C@H](C[C@H](O)\C=C\C1=C(C2=CC=C(F)C=C2)C2=CC=CC=C2N=C1C1CC1)CC(O)=O

Compound class


Hydroxymethylglutaryl-CoA Reductase Inhibitors; Hypolipidemic Agents; HMG CoA Reductase Inhibitors; Lipid Modifying Agents, Plain; Lipid Modifying Agents; Cardiovascular System; Cytochrome P-450 CYP2C9 Inhibitors; Cytochrome P-450 CYP2C8 Inhibitors; Cytochrome P-450 CYP2C9 Inducers; Cytochrome P-450 CYP2C8 Inducers;

Therapeutic area


Pitavastatin is used to lower serum levels of total cholesterol, LDL-C, apolipoprotein B, and triglycerides, and raise levels of HDL-C for the treatment of dyslipidemia.

Common name


Pitavastatin

IUPAC name


(3R,5S,6E)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3,5-dihydroxyhept-6-enoic acid

SMILES


O[C@H](C[C@H](O)\C=C\C1=C(C2=CC=C(F)C=C2)C2=CC=CC=C2N=C1C1CC1)CC(O)=O

INCHI


InChI=1S/C25H24FNO4/c26-17-9-7-15(8-10-17)24-20-3-1-2-4-22(20)27-25(16-5-6-16)21(24)12-11-18(28)13-19(29)14-23(30)31/h1-4,7-12,16,18-19,28-29H,5-6,13-14H2,(H,30,31)/b12-11+/t18-,19-/m1/s1

FORMULA


C25H24FNO4

Responsive image

Common name


Pitavastatin

IUPAC name


(3R,5S,6E)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3,5-dihydroxyhept-6-enoic acid

Molecular weight


421.461

clogP


5.371

clogS


-5.008

HBond Acceptor


5

HBond Donor


3

Total Polar
Surface Area


90.65

Number of Rings


4

Rotatable Bond


8

Drug ID Common name Structure CAS SMILE Frequency
FDBF00152 (3R)-3-hydroxybutanoic acid Responsive image C(O)(C)CC(=O)O 0.0017
FDBF02486 (3S)-pent-4-ene-1,3-diol Responsive image C(C(O)C=C)CO 0.0010
FDBF03734 (E)-3-(3-quinolyl)prop-2-en-1-ol Responsive image n1cc(cc2c1cccc2)C=CCO 0.0003
13 , 2