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Compound Detail

CHEMBL1189955

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O=C1CN2Cc3c(sc4c3CNCC4)N=C2N1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1189955
Phase Preclinical
Structure Type MOL
InChI Key NWVQDQWEZBLSOA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

248.3
MW (Da)
0.33
ALogP
5
HBA
2
HBD
56.7
PSA (Ų)
0.70
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H12N4OS
MW 248.31
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness -0.92

Data from ChEMBL 36 via Core Engine