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Compound Detail

CHEMBL32985

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Clc1cccc(Cl)c1CO/N=C/c1cc[n+](CCC[n+]2ccc(/C=N/OCc3c(Cl)cccc3Cl)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL32985
Phase Preclinical
Structure Type MOL
InChI Key RAHLDBGBLYIYDN-WKCPDWHCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

604.4
MW (Da)
7.07
ALogP
4
HBA
0
HBD
50.9
PSA (Ų)
0.10
QED
2
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H26Cl4N4O2+2
MW 604.37
Aromatic Rings 4
Heavy Atoms 39
NP-Likeness -0.51

Data from ChEMBL 36 via Core Engine