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Compound Detail

CHEMBL1196063

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N=c1ccc(-c2ccc(Cl)cc2)nn1Cc1cc(O)ns1

Basic Information

ChEMBL ID CHEMBL1196063
Phase Preclinical
Structure Type MOL
InChI Key IOOGUHXPDYRXFJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

318.8
MW (Da)
2.89
ALogP
6
HBA
2
HBD
74.8
PSA (Ų)
0.78
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 C14H11ClN4OS
MW 318.79
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -1.50

Data from ChEMBL 36 via Core Engine