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Compound Detail

CHEMBL3719290

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C#Cc1cc(OC)c(C(C)C)c(Oc2cnc(N)nc2N)c1

Basic Information

ChEMBL ID CHEMBL3719290
Phase Preclinical
Structure Type MOL
InChI Key RVXIANIRODQVBY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

298.4
MW (Da)
2.55
ALogP
6
HBA
2
HBD
96.3
PSA (Ų)
0.84
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H18N4O2
MW 298.35
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -0.27

Data from ChEMBL 36 via Core Engine