Compound - Results

Quetiapine

Java required.


Information Structure
Name Quetiapine
Synonyms
2-(2-(4-Dibenzo(b,f)(1,4)thiazepin-11-yl-1-piperazinyl)ethoxy)ethanol
Quetiapine
Seroquel
ATC N05AH04
CID 5002
CAS 111974697
Drugbank ID DB01224
TTD Drug ID DCL000941
SMILES OCCOCCN1CCN(CC1)C2=NC3=C(SC4=C2C=CC=C4)C=CC=C3
Formula C21H25N3O2S
Molweight 383.507
Atoms 27
LogP 2.1674
Rotatable Bonds 6
H-Bond Donors 0
H-Bond Acceptors 4
CYP interactions
NameRelationsReferences
2C19Substrate 15516294
2D6Substrate Inhibitor 15516294
umm
3A4Substrate 10422890
11199955
12670127
10843459
3A5Substrate medicine.iupui.edu/flockhart
3A7Substrate medicine.iupui.edu/flockhart