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Compound Detail

CHEMBL1195999

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Cn1cnc2c(=O)n(Cc3ccccc3)c3ccccc3c21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1195999
Phase Preclinical
Structure Type MOL
InChI Key NENUERHVIPDEIH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

289.3
MW (Da)
2.94
ALogP
4
HBA
0
HBD
39.8
PSA (Ų)
0.57
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H15N3O
MW 289.34
Aromatic Rings 4
Heavy Atoms 22
NP-Likeness -0.90

Data from ChEMBL 36 via Core Engine