Compound - Results

Ritonavir

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Information Structure
Name Ritonavir
Synonyms
5-Thiazolylmethyl ((alphaS)-alpha-((1S,3S-1-hydroxy-3-((2S)-2-(3-((2-isopropyl-4-thiazolyl)methyl)-3-methylureido)-3-methylbutyramido)-4-phenylbutyl)p
A-84538
Abbott 84538
ABT-538
DRG-0244
Norvir
Ritonavir
ATC J05AE03
CID 392622
CAS 155213675
Drugbank ID DB00503
TTD Drug ID DAP000169
SMILES CC(C)[C@@H](NC(=O)N(C)CC1=CSC(=N1)C(C)C)C(=O)N[C@H](C[C@H](O)[C@H](CC2=CC=CC=C2)NC(=O)OCC3=CN=CS3)CC4=CC=CC=C4
Formula C37H48N6O5S2
Molweight 720.944
Atoms 54
LogP 7.0779
Rotatable Bonds 22
H-Bond Donors 0
H-Bond Acceptors 10
CYP interactions
NameRelationsReferences
1A2Substrate Inhibitor Inducer umm
17542771
2B6Substrate Inhibitor Inducer 11159797
14977870
14977870
umm
2C8Inhibitor Inducer umm
15601807
2C9Inhibitor Inducer 8613951
9812178
10930961
8613951
9549640
9812178
2C19Inhibitor Inducer 9549640
9812178
9549640
9812178
2D6Substrate Inhibitor umm
8613951
9758674
9549640
12410055
8613951
9549640
2E1Inhibitor umm
3A4Substrate Inhibitor Inducer umm
16162970
15544435
15492266
16432264
16433896
15762770
9616191
8613951
9278209
medicine.iupui.edu/flockhart
8613951
10668858
16513448
3A5Substrate Inhibitor Inducer medicine.iupui.edu/flockhart
8613951
16513448
15523003
10641980
14985144
19238656
3A7Substrate Inhibitor medicine.iupui.edu/flockhart
8613951
16513448
16433896
16433896
7A1Inhibitor 16861219
Phase2 interactions
NameReferences
UGT 16118329
Transporter
AC-No.NameReferences
A5D8U6ABCA1 protein 18849545
O94956Solute carrier organic anion transporter family member 2B120507927
P33527LTC4 transporter11745741
P46721Solute carrier organic anion transporter family member 1A220628435
P78381UDP-galactose translocator 16118329
Q14973Na(+)/taurocholate transport protein16720753
Q92887Canalicular multispecific organic anion transporter 112441801
Q9UNQ0ATP-binding cassette sub-family G member 216322314
Extrarenal fraction 0.7
Elimination half-life 4h