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Compound Detail

CHEMBL1980903

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Fc1ccc(OCCSc2nc3cccnc3[nH]2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1980903
Phase Preclinical
Structure Type MOL
InChI Key ZXOZKQGDHGINOE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

289.3
MW (Da)
3.27
ALogP
4
HBA
1
HBD
50.8
PSA (Ų)
0.58
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H12FN3OS
MW 289.34
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -2.23

Data from ChEMBL 36 via Core Engine