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Compound Detail

CHEMBL353719

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COc1ccc(-c2nc3c(C(=O)NCCN(C)C)cccc3[nH]2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL353719
Phase Preclinical
Structure Type MOL
InChI Key BLUWJJYWHKIIPE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

338.4
MW (Da)
2.53
ALogP
4
HBA
2
HBD
70.2
PSA (Ų)
0.72
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H22N4O2
MW 338.41
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -1.25

Data from ChEMBL 36 via Core Engine