GDC-0994 - Small Molecule (ID:10375-101)

HMS LINCS ID: 10375-101
Name: GDC-0994
Alternative Names:
LINCS ID:
PubChem CID: 71727581
ChEBI ID:
ChEMBL ID:
Molecular Mass: 440.12
InChi: InChI=1S/C21H18ClFN6O2/c1-28-19(5-8-25-28)27-21-24-7-4-17(26-21)13-6-9-29(20(31)11-13)18(12-30)14-2-3-15(22)16(23)10-14/h2-11,18,30H,12H2,1H3,(H,24,26,27)/t18-/m1/s1
InChi Key: RZUOCXOYPYGSKL-GOSISDBHSA-N
SMILES: CN1C(NC2=NC=CC(C3=CC(N([C@@H](C4=CC(F)=C(Cl)C=C4)CO)C=C3)=O)=N2)=CC=N1
Relevant Citations:
Comments:
Date Publicly Available:
Most Recent Update: 2016-04-04

Target Affinity:

(see Study 20000)
Target Affinity Spectrum Value HUGO Gene Name
2
(equivalent to 100 nM ≤ Kd < 1µM)
MAPK1, MAPK3

Batch Information for HMSL10375-101-1:

HMS LINCS Batch ID: 10375-101-1
Provider: MedChem Express
Provider Batch ID: 14696
Salt: 101
Molecular Formula: C21H18ClFN6O2
Molecular Weight: 440.86
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2015-08-27
Most Recent Update: 2016-04-04

HMS QC Testing Events for HMSL10375-101-1:

Date HMS QC Outcome Comment Files
08/31/2015 PASS HMSL10375-101-1_NMR.pdf,
HMSL10375-101-1_LCMS.pdf