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Compound Detail

CHEMBL5498958

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CC[C@H](C)CCc1cnc(Cl)c(/C=C/c2ccncc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5498958
Phase Preclinical
Structure Type MOL
InChI Key RSXPTYRGJDGQJN-UZYOAWRESA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

300.8
MW (Da)
5.28
ALogP
2
HBA
0
HBD
25.8
PSA (Ų)
0.68
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H21ClN2
MW 300.83
Aromatic Rings 2
Heavy Atoms 21

Data from ChEMBL 36 via Core Engine