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Compound Detail

CHEMBL1565651

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CCCN(Cc1cc2ccc(C)cc2nc1O)C(=O)c1ccccn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1565651
Phase Preclinical
Structure Type MOL
InChI Key XLYAGNZIBZOLQP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

335.4
MW (Da)
3.70
ALogP
4
HBA
1
HBD
66.3
PSA (Ų)
0.77
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 C20H21N3O2
MW 335.41
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -1.81

Data from ChEMBL 36 via Core Engine