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BDBM50410036 CHEMBL179761

SMILES: NC(=O)c1cccc(c1)N1[C@H](CCc2ccccc2)[C@@H](O)[C@@H](Cc2ccccc2)N(C1=O)c1cccc(c1)C(N)=O

InChI Key: InChIKey=LUOOIXNNRYGGEB-IDZRBWSNSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50410036   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Human immunodeficiency virus type 1 protease


(Human immunodeficiency virus type 1)		BDBM50410036
PNG
(CHEMBL179761)
Show SMILES NC(=O)c1cccc(c1)N1[C@H](CCc2ccccc2)[C@@H](O)[C@@H](Cc2ccccc2)N(C1=O)c1cccc(c1)C(N)=O
Show InChI InChI=1S/C33H32N4O4/c34-31(39)24-13-7-15-26(20-24)36-28(18-17-22-9-3-1-4-10-22)30(38)29(19-23-11-5-2-6-12-23)37(33(36)41)27-16-8-14-25(21-27)32(35)40/h1-16,20-21,28-30,38H,17-19H2,(H2,34,39)(H2,35,40)/t28-,29-,30-/m1/s1
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PC cid
PC sid
UniChem

Similars
Article
PubMed
 0.0871n/an/an/an/an/an/an/an/a



Clarkson University

Curated by ChEMBL


Assay Description
Antiviral activity potency was assessed by measuring effect on the accumulation of viral RNA transcripts 3 days after infection of MT-2 cells with HI...

Bioorg Med Chem Lett 15: 3767-70 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.087
BindingDB Entry DOI: 10.7270/Q2SQ91KF
More data for this
Ligand-Target Pair