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Compound Detail

CHEMBL284140

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CCc1nc2ccc(C3=NN(CC(=O)N(C)C)C(=O)CC3)cc2n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL284140
Phase Preclinical
Structure Type MOL
InChI Key GIRBOQWXCXMIRR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

561.6
MW (Da)
3.91
ALogP
8
HBA
1
HBD
125.3
PSA (Ų)
0.31
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C31H31N9O2
MW 561.65
Aromatic Rings 5
Heavy Atoms 42
NP-Likeness -1.51

Data from ChEMBL 36 via Core Engine