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Compound Detail

CHEMBL1194573

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CCOc1cc2c(-c3ccnc(-n4nc(-c5cccnc5)c5ccccc5c4=O)c3)c(CO)c(CO)cc2cc1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1194573
Phase Preclinical
Structure Type MOL
InChI Key MZWIXTAQIAHGBV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

560.6
MW (Da)
5.05
ALogP
9
HBA
2
HBD
119.6
PSA (Ų)
0.27
QED
2
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C33H28N4O5
MW 560.61
Aromatic Rings 6
Heavy Atoms 42
NP-Likeness -0.55

Data from ChEMBL 36 via Core Engine