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Compound Detail

CHEMBL4300044

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CN(C(=O)CCCC(=O)N(C)c1ccc(C(=N)N)cc1)c1ccc(C(=N)N)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4300044
Phase Preclinical
Structure Type MOL
InChI Key ZCJLABSKZCOJAS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

394.5
MW (Da)
2.05
ALogP
4
HBA
4
HBD
140.4
PSA (Ų)
0.40
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H26N6O2
MW 394.48
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -0.57

Data from ChEMBL 36 via Core Engine