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Compound Detail

CHEMBL1470280

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O=C1C2C(c3ccccc3)=NN(c3ccccc3)C2C(=O)N1c1ccccc1

Basic Information

ChEMBL ID CHEMBL1470280
Phase Preclinical
Structure Type MOL
InChI Key MHBMGMSLBVUTMO-UHFFFAOYSA-N
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

367.4
MW (Da)
3.47
ALogP
4
HBA
0
HBD
53.0
PSA (Ų)
0.67
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H17N3O2
MW 367.41
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -0.83

Activity Summary

EC50 3 meas. best 6.15

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Streptokinase A
CHEMBL1293228
EC50 6.15 6.15 704.0 1
Streptococcus sp. 'group A'
CHEMBL612389
EC50 5.99 5.99 1017.0 1
Streptococcus
CHEMBL612313
EC50 5.29 5.29 5110.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine