Compound Detail

CHEMBL2063185

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CCCCCCCCCCCCCCCCOCCCOP(=O)(CCOCCn1cnc2c(=O)[nH]cnc21)OCCCOCCCCCCCCCCCCCCCC

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL2063185
Phase	Preclinical
Structure Type	MOL
InChI Key	BXKMBCJOXWKYJL-UHFFFAOYSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

853.2

MW (Da)

13.14

ALogP

HBA

HBD

126.8

PSA (Å²)

0.05

QED

Ro5 Violations

Rot. Bonds

First in Class Prodrug

PubMed	DOI	Target Context	# Activities
22858222	10.1016/j.ejmech.2012.07.027	Human alphaherpesvirus 3	4
22858222	10.1016/j.ejmech.2012.07.027	Human alphaherpesvirus 1	2
22858222	10.1016/j.ejmech.2012.07.027	Human betaherpesvirus 5	2
22858222	10.1016/j.ejmech.2012.07.027	HEL	2
22858222	10.1016/j.ejmech.2012.07.027	Human alphaherpesvirus 2	1
22858222	10.1016/j.ejmech.2012.07.027	Felid alphaherpesvirus 1	1
22858222	10.1016/j.ejmech.2012.07.027	Vaccinia virus	1
22858222	10.1016/j.ejmech.2012.07.027	Human immunodeficiency virus 1	1
22858222	10.1016/j.ejmech.2012.07.027	Human immunodeficiency virus 2	1
22858222	10.1016/j.ejmech.2012.07.027	Vesicular stomatitis virus	1
22858222	10.1016/j.ejmech.2012.07.027	Coxsackievirus B4	1
22858222	10.1016/j.ejmech.2012.07.027	Respiratory syncytial virus	1
22858222	10.1016/j.ejmech.2012.07.027	Human respirovirus 3	1
22858222	10.1016/j.ejmech.2012.07.027	Mammalian orthoreovirus 1	1
22858222	10.1016/j.ejmech.2012.07.027	Sindbis virus	1
22858222	10.1016/j.ejmech.2012.07.027	Punta Toro virus	1

Data from ChEMBL 36 via Core Engine