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Compound Detail

CHEMBL5832378

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COc1ccccc1[C@H](Cn1c(=O)n(C2(C(=O)O)CC2)c(=O)c2c(C)c(-n3cccn3)sc21)OC1CCOCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5832378
Phase Preclinical
Structure Type MOL
InChI Key FOCNNKJEVICURK-NRFANRHFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

566.6
MW (Da)
3.24
ALogP
11
HBA
1
HBD
126.8
PSA (Ų)
0.33
QED
2
Ro5 Violations
9
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H30N4O7S
MW 566.64
Aromatic Rings 4
Heavy Atoms 40
NP-Likeness -0.79

Data from ChEMBL 36 via Core Engine