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BDBM50050827 (S)-2-((S)-3-Carboxy-2-{(S)-2-[(S)-3-methyl-2-(3-methyl-ureido)-butyrylamino]-4-oxo-4-pyrrolidin-1-yl-butyrylamino}-propionylamino)-4-methyl-pentanoic acid::CHEMBL303618

SMILES: CNC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)N1CCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O

InChI Key: InChIKey=OIBQDRADGJEXQS-BOSXTWCSSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50050827   
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
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)		BDBM50050827
PNG
((S)-2-((S)-3-Carboxy-2-{(S)-2-[(S)-3-methyl-2-(3-m...)
Show SMILES CNC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)N1CCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C25H42N6O9/c1-13(2)10-17(24(38)39)29-22(36)16(12-19(33)34)27-21(35)15(11-18(32)31-8-6-7-9-31)28-23(37)20(14(3)4)30-25(40)26-5/h13-17,20H,6-12H2,1-5H3,(H,27,35)(H,28,37)(H,29,36)(H,33,34)(H,38,39)(H2,26,30,40)/t15-,16-,17-,20-/m0/s1
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 4.20E+4n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)

J Med Chem 39: 2178-87 (1996)


Article DOI: 10.1021/jm950825x
BindingDB Entry DOI: 10.7270/Q2BG2N22
More data for this
Ligand-Target Pair