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Compound Detail

CHEMBL5499958

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CNCc1nc(-c2ccnc(Nc3cc(NC(=O)C4CC4)nnc3C(=O)NC)c2OC)no1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5499958
Phase Preclinical
Structure Type MOL
InChI Key RALRIKNFDJALGQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

453.5
MW (Da)
1.10
ALogP
11
HBA
4
HBD
169.1
PSA (Ų)
0.37
QED
1
Ro5 Violations
9
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H23N9O4
MW 453.46
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -1.58

Data from ChEMBL 36 via Core Engine