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Compound Detail

CHEMBL4301956

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CC(C)NC(=N)c1ccc2nc(N3Cc4ccccc4C3=O)sc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4301956
Phase Preclinical
Structure Type MOL
InChI Key XROKUTKJNPNOAD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

350.4
MW (Da)
3.78
ALogP
4
HBA
2
HBD
69.1
PSA (Ų)
0.56
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H18N4OS
MW 350.45
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -1.25

Data from ChEMBL 36 via Core Engine