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Compound Detail

CHEMBL1458054

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O=C(c1ccccc1)c1cnc(-c2ccccc2)s1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1458054
Phase Preclinical
Structure Type MOL
InChI Key LWTNKOJBANXELS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

265.3
MW (Da)
4.04
ALogP
3
HBA
0
HBD
30.0
PSA (Ų)
0.67
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 C16H11NOS
MW 265.34
Aromatic Rings 3
Heavy Atoms 19
NP-Likeness -1.18

Data from ChEMBL 36 via Core Engine