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Compound Detail

CHEMBL4803723

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Clc1ccc2[nH]c3c(c2c1)CCNC3c1ccccc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4803723
Phase Preclinical
Structure Type MOL
InChI Key AEPMXQSSUQOYBN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

317.2
MW (Da)
4.71
ALogP
1
HBA
2
HBD
27.8
PSA (Ų)
0.67
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H14Cl2N2
MW 317.22
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -0.31

Data from ChEMBL 36 via Core Engine