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Compound Detail

CHEMBL5499679

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O=C(N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1)c1cc2c(s1)OCCn1ncc(CCO)c1-2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5499679
Phase Preclinical
Structure Type MOL
InChI Key JGIUDZWKRBMKCR-HNAYVOBHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

474.5
MW (Da)
2.69
ALogP
7
HBA
3
HBD
88.4
PSA (Ų)
0.53
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H24F2N4O3S
MW 474.53
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -0.86

Data from ChEMBL 36 via Core Engine