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Compound Detail

CHEMBL1501864

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C1=C(c2ccc(-c3ccccc3)cc2)Nc2ncnn2C1c1ccco1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1501864
Phase Preclinical
Structure Type MOL
InChI Key MSMZLFRGZQEXER-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

340.4
MW (Da)
4.59
ALogP
5
HBA
1
HBD
55.9
PSA (Ų)
0.59
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 C21H16N4O
MW 340.39
Aromatic Rings 4
Heavy Atoms 26
NP-Likeness -1.07

Data from ChEMBL 36 via Core Engine