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Compound Detail

CHEMBL4803672

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CC1(C)C(Cc2c(Cl)cccc2Cl)C(=[N+]2CCCC2)C=CN1Cc1c(Cl)cccc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4803672
Phase Preclinical
Structure Type MOL
InChI Key QOTMPRUCXGGORJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

497.3
MW (Da)
7.51
ALogP
1
HBA
0
HBD
6.2
PSA (Ų)
0.40
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H27Cl4N2+
MW 497.32
Aromatic Rings 2
Heavy Atoms 31
NP-Likeness -0.02

Data from ChEMBL 36 via Core Engine