PP2

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H16ClN5
Molecular Weight	301.774
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)(C)N1N=C(C2=C1N=CN=C2N)C3=CC=C(Cl)C=C3

InChI

InChIKey=PBBRWFOVCUAONR-UHFFFAOYSA-N

InChI=1S/C15H16ClN5/c1-15(2,3)21-14-11(13(17)18-8-19-14)12(20-21)9-4-6-10(16)7-5-9/h4-8H,1-3H3,(H2,17,18,19)

HIDE SMILES / InChI

Molecular Formula	C15H16ClN5
Molecular Weight	301.774
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Potency
Tyrosine-protein kinase LCK 12 Target ID: CHEMBL258 Sources: https://www.ncbi.nlm.nih.gov/pubmed/8557675 \| https://www.ncbi.nlm.nih.gov/pubmed/18077363	Inhibitor 8297	4.0 nM [IC50]
Tyrosine-protein kinase FYN 6 Target ID: CHEMBL1841 Sources: https://www.ncbi.nlm.nih.gov/pubmed/8557675	Inhibitor 8297	5.0 nM [IC50]
Tyrosine-protein kinase SRC 19 Target ID: CHEMBL267 Sources: https://www.ncbi.nlm.nih.gov/pubmed/20570525	Inhibitor 8297	50.0 nM [IC50]

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:24:07 UTC 2023` Edited by `admin` on `Sat Dec 16 18:24:07 UTC 2023`
Record UNII	PK8JPC58XB
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PP2

Common Name

English

1H-Pyrazolo[3,4-d]pyrimidin-4-amine, 3-(4-chlorophenyl)-1-(1,1-dimethylethyl)-

Systematic Name

English

4-Amino-3-(4-chlorophenyl)-1-(t-butyl)-1H-pyrazolo[3,4-d]pyrimidine

Systematic Name

English

3-(4-Chlorophenyl)-1-(1,1-dimethylethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Systematic Name

English

PP2 (enzyme inhibitor)

Common Name

English

1-tert-Butyl-3-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systematic Name

English

1-TERT-BUTYL-3-(4-CHLORO-PHENYL)-1H-PYRAZOLO(3,4-D)PYRIMIDIN-4-YLAMINE

Systematic Name

English

Src kinase inhibitor PP2

Common Name

English

AGL-1879

Common Name

English

Code System Code Type Description

FDA UNII

PK8JPC58XB