General Information of the Compound
Compound ID
CP0117509
Compound Name
6-(6-aminopyrazin-2-yl)-N-(4-(4-(oxetan-3-yl)piperazin-1-yl)phenyl)imidazo[1,2-a]pyrazin-8-amine
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Synonyms
6-(6-Aminopyr
6-(6-Aminopyrazin-2-yl)-N-(4-(4-(oxetan-3-yl)piperazin-1-yl)phenyl)imidazo[1,2-a]pyrazin-8-amine
6-(6-aminopyrazin-2-yl)-N-[4-[4-(oxetan-3-yl)piperazin-1-yl]phenyl]imidazo[1,2-a]pyrazin-8-amine
A6U64OU57E
BDBM212271
CHEMBL3986824
Ex.-2, US9290505
GS-9876
GS9876
GTPL9764
Imidazo(1,2-a)pyrazin-8-amine, 6-(6-amino-2-pyrazinyl)-N-(4-(4-(3-oxetanyl)-1-piperazinyl)phenyl)-
Lanraplenib [INN]
SCHEMBL16820581
UNII-A6U64OU57E
US9290505, Ex.-2
XCIGZBVOUQVIPI-UHFFFAOYSA-N
example 2 [US9290505]
lanraplenib
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Structure
Formula
C23H25N9O
Molecular Weight
443.515
Canonical SMILES
Nc1cncc(n1)-c1cn2ccnc2c(Nc2ccc(cc2)N2CCN(CC2)C2COC2)n1
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InChI
InChI=1S/C23H25N9O/c24-21-12-25-11-19(28-21)20-13-32-6-5-26-23(32)22(29-20)27-16-1-3-17(4-2-16)30-7-9-31(10-8-30)18-14-33-15-18/h1-6,11-13,18H,7-10,14-15H2,(H2,24,28)(H,27,29)
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InChIKey
XCIGZBVOUQVIPI-UHFFFAOYSA-N
CAS
1800046-95-0
Physicochemical Property
logP
2.0329
Rotatable Bonds
5
Heavy Atom Count
33
Polar Areas
109.73
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
10
Complexity
33

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 118161062
ChEMBL ID
CHEMBL3986824
DrugBank ID
DB14770
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01441, Tyrosine-protein kinase SYK
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000003 Ramos
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 24 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Biochemical Assays
1 EC50 = 90 nM
2 EC50 = 180 nM
3 EC50 = 700 nM
4 IC50 = 6.2 nM
Clinical Information about the Compound
Drug 1 ( GS-9876 )
Drug Name GS-9876
Company Gilead Sciences Foster City, CA
Indication
Cutaneous lupus erythematosus
Phase 2
Rheumatoid arthritis
Phase 1
Target(s)
Tyrosine-protein kinase SYK (SYK)
 Target Info 
Inhibitor