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Compound Detail

CHEMBL1624014

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Cc1ccc2sc(N(CCCN(C)C)C(=O)c3ccc(Br)s3)nc2c1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1624014
Phase Preclinical
Structure Type MOL
InChI Key OQRUBFMHLUDBBU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

452.4
MW (Da)
5.34
ALogP
5
HBA
0
HBD
36.4
PSA (Ų)
0.51
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H22BrN3OS2
MW 452.44
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -2.38

Data from ChEMBL 36 via Core Engine