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Compound Detail

CHEMBL1193785

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CCC1(OC(=O)CN)C(=O)OCc2c1cc1n(c2=O)Cc2cc3cc4c(cc3nc2-1)OCO4

Basic Information

ChEMBL ID CHEMBL1193785
Phase Preclinical
Structure Type MOL
InChI Key ZCVLTIWFTLQSTM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

449.4
MW (Da)
1.32
ALogP
10
HBA
1
HBD
132.0
PSA (Ų)
0.46
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H19N3O7
MW 449.42
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness 0.92

Data from ChEMBL 36 via Core Engine