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Compound Detail

CHEMBL4114743

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C/C(=N\N1CCNC1=O)c1cnc2nnn(Cc3cc4cccnc4cc3F)c2n1

Basic Information

ChEMBL ID CHEMBL4114743
Phase Preclinical
Structure Type MOL
InChI Key ISCCHVIRTOEBAV-KBKYJPHKSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

405.4
MW (Da)
1.71
ALogP
8
HBA
1
HBD
114.1
PSA (Ų)
0.52
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H16FN9O
MW 405.40
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -1.66

Activity Summary

IC50 1 meas. best 8.05

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Hepatocyte growth factor receptor
CHEMBL3717
IC50 8.05 8.05 9.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine