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Compound Detail

CHEMBL2021703

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CC(C)[C@@H](CNC(=O)c1nc(Cl)c(N)nc1N)[N+](C)(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2021703
Phase Preclinical
Structure Type MOL
InChI Key VUIQQQXCPLQUKM-MRVPVSSYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

315.8
MW (Da)
0.75
ALogP
5
HBA
3
HBD
106.9
PSA (Ų)
0.70
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H24ClN6O+
MW 315.83
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness -0.45

Data from ChEMBL 36 via Core Engine