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Compound Detail

CHEMBL3545695

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Clc1cccc(CN(CC2CNC2)c2ccccc2)c1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3545695
Phase Preclinical
Structure Type MOL
InChI Key NYAMMVCLXKPMKS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

321.2
MW (Da)
4.22
ALogP
2
HBA
1
HBD
15.3
PSA (Ų)
0.89
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 C17H18Cl2N2
MW 321.25
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -1.17

Data from ChEMBL 36 via Core Engine