BDBM50164652 2',3'-Dideoxynucleoside5'-alpha-P-Borano-beta,gamma-(difluoromethylene)triphosphates derivative::CHEMBL192192

SMILES: [BH3-]P(=O)(OCC1CC(C=C1)n1cnc2c1nc(N)[nH]c2=O)OP([O-])(=O)C(F)(F)P([O-])([O-])=O

InChI Key: InChIKey=YJZPAJLQSASFHE-UHFFFAOYSA-K

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50164652   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50164652 (2',3'-Dideoxynucleoside5'-alpha-P-Borano-beta,gamm...) Show SMILES [BH3-]P(=O)(OCC1CC(C=C1)n1cnc2c1nc(N)[nH]c2=O)OP([O-])(=O)C(F)(F)P([O-])([O-])=O |c:8| Show InChI InChI=1S/C12H18BF2N5O9P3/c13-32(27,29-31(25,26)12(14,15)30(22,23)24)28-4-6-1-2-7(3-6)20-5-17-8-9(20)18-11(16)19-10(8)21/h1-2,5-7H,3-4H2,13H3,(H,25,26)(H2,22,23,24)(H3,16,18,19,21)/q-1/p-3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	34	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Biota, Inc. Curated by ChEMBL					Assay Description Inhibitory constant against HIV-1 reverse transcriptase				J Med Chem 48: 2695-700 (2005) Article DOI: 10.1021/jm040101y BindingDB Entry DOI: 10.7270/Q2G73FG5
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