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Compound Detail

CHEMBL3041327

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C[n+]1c(/C=C/c2c[nH]c3ncccc23)cc(N)c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3041327
Phase Preclinical
Structure Type MOL
InChI Key VTHGPZOOTUCIGS-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

301.4
MW (Da)
3.29
ALogP
2
HBA
2
HBD
58.6
PSA (Ų)
0.56
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 C19H17N4+
MW 301.37
Aromatic Rings 4
Heavy Atoms 23
NP-Likeness -0.23

Data from ChEMBL 36 via Core Engine