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Compound Detail

CHEMBL1618674

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Clc1cccc(C[n+]2cc(-c3ccccc3)n3c2CCC3)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1618674
Phase Preclinical
Structure Type MOL
InChI Key IKCLCMAJERYEHU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

309.8
MW (Da)
4.09
ALogP
1
HBA
0
HBD
8.8
PSA (Ų)
0.64
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H18ClN2+
MW 309.82
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -1.05

Data from ChEMBL 36 via Core Engine