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Compound Detail

CHEMBL1625265

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N=c1n(CC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2n1Cc1ccc(Cl)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1625265
Phase Preclinical
Structure Type MOL
InChI Key CRQPWVDVPSXOAH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

420.9
MW (Da)
4.42
ALogP
6
HBA
1
HBD
93.9
PSA (Ų)
0.28
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H17ClN4O3
MW 420.86
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -1.35

Data from ChEMBL 36 via Core Engine