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Compound Detail

CHEMBL6052648

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CCn1c(-c2cccnc2[C@H](C)OC)c2c3cc(ccc31)-c1csc(n1)C[C@H](NC(=O)[C@H](C(C)C)N(C)C(=O)N1CCC13CN(C(=O)/C=C/CN1CCOCC1)C3)C(=O)N1CCC[C@H](N1)C(=O)OCC(C)(C)C2

Basic Information

ChEMBL ID CHEMBL6052648
Phase Preclinical
Structure Type MOL
InChI Key HMUWRTCEMXGYOA-YELLNZCVSA-N
3
Targets
12
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

1021.3
MW (Da)

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C54H72N10O8S
MW 1021.30

Activity Summary

IC50 12 meas. best 7.26

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
IC50 7.26 6.635 55.0 8
GTPase NRas
CHEMBL2079845
IC50 6.26 6.26 550.0 1
GTPase KRas
CHEMBL2189121
IC50 6.26 5.9267 550.0 3

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine