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Compound Detail

CHEMBL3890666

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CCc1ccc2[nH]c3nc(N/N=C/c4ccc(Cl)cc4)nnc3c2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3890666
Phase Preclinical
Structure Type MOL
InChI Key FYQOGZGMVKTJJF-KEBDBYFISA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

350.8
MW (Da)
4.17
ALogP
5
HBA
2
HBD
78.8
PSA (Ų)
0.43
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 C18H15ClN6
MW 350.81
Aromatic Rings 4
Heavy Atoms 25
NP-Likeness -1.73

Data from ChEMBL 36 via Core Engine