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SIMM · NJU
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SIMM · NJU
Compound
PGDB_C021979
20 activity records
1 related patents
2D structure
Fc1cccc(C2=CCN(Cc3ccc4c(c3)NC4=S)CC2)c1Cl
Compound summary
Compound ID
PGDB_C021979
Formula
C19H16ClFN2S
Molecular weight
358.869
InChIKey
GADMYNVAAIKJCE-UHFFFAOYSA-N
Physicochemical properties
Exact mass
358.0707
RDKit cLogP
4.87
TPSA
15.3
HBD / HBA
1 / 2
Rotatable bonds
3
Heavy atoms
24
Hetero atoms
5
Rings / aromatic
4 / 2
Fraction Csp3
0.21
Formal charge
0
Fragments
1
Activity compounds and values
Activity records
20 records
Structure
Metric
Control
Relation
Value
Unit
Concentration
Time
Target
E3
Cell line
Patent
Record ID
Compound
Assay
Details
% Inhibition
-
=
80-100
%
500 nM
96 h
-
-
RPMI-8226
CN119654316A
PGDB_A082315
PGDB_C021979
PGDB_AS000560
View
% Degradation
-
=
0-80
%
-
-
GSPT1
-
-
CN119654316A
PGDB_A082609
PGDB_C021979
PGDB_AS000660
View
% Inhibition
-
=
70-80
%
10 nM
96 h
-
-
MOLT-4
CN119654316A
PGDB_A082887
PGDB_C021979
PGDB_AS002038
View
% Inhibition
-
=
50-60
%
10 nM
-
-
-
MM.1S
CN119654316A
PGDB_A083008
PGDB_C021979
PGDB_AS000042
View
% Degradation
-
=
0-80
%
-
-
IKZF2
-
-
CN119654316A
PGDB_A083110
PGDB_C021979
PGDB_AS002430
View
% Inhibition
-
=
80-100
%
10 nM
-
-
-
MV-4-11
CN119654316A
PGDB_A083526
PGDB_C021979
PGDB_AS000053
View
% Inhibition
-
=
60-80
%
2 uM
3 h
CRBN
CRBN
-
CN119654316A
PGDB_A083640
PGDB_C021979
PGDB_AS002552
View
% Degradation
-
=
0-80
%
-
-
IKZF1
-
-
CN119654316A
PGDB_A083775
PGDB_C021979
PGDB_AS001680
View
% Inhibition
-
=
80-100
%
500 nM
96 h
-
-
MOLT-4
CN119654316A
PGDB_A083782
PGDB_C021979
PGDB_AS000121
View
% Degradation
-
=
0-80
%
-
-
IKZF3
-
-
CN119654316A
PGDB_A083820
PGDB_C021979
PGDB_AS000017
View
% Inhibition
-
=
80-100
%
10 nM
96 h
-
-
RPMI-8226
CN119654316A
PGDB_A083864
PGDB_C021979
PGDB_AS001289
View
% Degradation
-
=
0-80
%
-
-
-
-
-
CN119654316A
PGDB_A083875
PGDB_C021979
PGDB_AS000466
View
% Inhibition
-
=
30-40
%
0.5 uM
3 h
CRBN
CRBN
-
CN119654316A
PGDB_A084176
PGDB_C021979
PGDB_AS001405
View
% Inhibition
-
=
80-100
%
500 nM
-
-
-
CCRF-CEM
CN119654316A
PGDB_A084337
PGDB_C021979
PGDB_AS002221
View
% Inhibition
-
=
80-100
%
10 nM
-
-
-
CCRF-CEM
CN119654316A
PGDB_A084351
PGDB_C021979
PGDB_AS001358
View
% Inhibition
-
=
80-100
%
500 nM
-
-
-
MCF-7
CN119654316A
PGDB_A084957
PGDB_C021979
PGDB_AS001118
View
% Inhibition
-
=
80-100
%
500 nM
-
-
-
MM.1S
CN119654316A
PGDB_A084996
PGDB_C021979
PGDB_AS000639
View
% Degradation
-
=
0-80
%
-
-
WEE1
-
-
CN119654316A
PGDB_A085167
PGDB_C021979
PGDB_AS001023
View
% Inhibition
-
=
0-5
%
10 nM
-
-
-
MCF-7
CN119654316A
PGDB_A085219
PGDB_C021979
PGDB_AS002350
View
% Inhibition
-
=
80-100
%
500 nM
-
-
-
MV-4-11
CN119654316A
PGDB_A085381
PGDB_C021979
PGDB_AS001323
View