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Compound Detail

CHEMBL1188762

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COc1cc2cc(CO)c(CO)c(-c3cccc(-n4nc(-c5cccnc5)c5ccccc5c4=O)n3)c2cc1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1188762
Phase Preclinical
Structure Type MOL
InChI Key OHASJOLVTWQDCA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

546.6
MW (Da)
4.66
ALogP
9
HBA
2
HBD
119.6
PSA (Ų)
0.30
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C32H26N4O5
MW 546.58
Aromatic Rings 6
Heavy Atoms 41
NP-Likeness -0.53

Data from ChEMBL 36 via Core Engine