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Compound Detail

CHEMBL5945158

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NS(=O)(=O)OC[C@H]1C[C@@H](Nc2ccnc3cc(-c4coc5ccc(Cl)cc45)nn23)[C@H](O)[C@@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5945158
Phase Preclinical
Structure Type MOL
InChI Key TWJBKYZEPMCECY-SDSNIYEDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

493.9
MW (Da)
1.54
ALogP
10
HBA
4
HBD
165.2
PSA (Ų)
0.31
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H20ClN5O6S
MW 493.93
Aromatic Rings 4
Heavy Atoms 33
NP-Likeness -0.40

Data from ChEMBL 36 via Core Engine