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Compound Detail

CHEMBL1184507

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CN(C/C(=N\OCCC[N+](C)(C)C)C(CCN1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(Cl)cc(Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1184507
Phase Preclinical
Structure Type MOL
InChI Key HLBLLGYOMVQROQ-BZDUDJNJSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

728.6
MW (Da)
7.49
ALogP
5
HBA
0
HBD
65.5
PSA (Ų)
0.09
QED
2
Ro5 Violations
14
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C35H48Cl4N5O3+
MW 728.61
Aromatic Rings 2
Heavy Atoms 47
NP-Likeness -0.83

Data from ChEMBL 36 via Core Engine