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Compound Detail

CHEMBL5917606

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C=CC(=O)Nc1cc(Nc2ncc(C(=O)OC(C)C)c(-c3nn(C)c4ccccc34)n2)c(OC)cc1N(C)CCN(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5917606
Phase Preclinical
Structure Type MOL
InChI Key BDKAGMNAOQQPRC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

586.7
MW (Da)
4.47
ALogP
11
HBA
2
HBD
126.7
PSA (Ų)
0.18
QED
2
Ro5 Violations
12
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C31H38N8O4
MW 586.70
Aromatic Rings 4
Heavy Atoms 43
NP-Likeness -1.22

Data from ChEMBL 36 via Core Engine