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Compound Detail

CHEMBL3186429

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COc1cc(OC)cc(C(=O)Nc2cc(N(C)C)ncn2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3186429
Phase Preclinical
Structure Type MOL
InChI Key VSFCGSVUQLWXTQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

302.3
MW (Da)
1.81
ALogP
6
HBA
1
HBD
76.6
PSA (Ų)
0.91
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 C15H18N4O3
MW 302.33
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -1.41

Data from ChEMBL 36 via Core Engine