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Compound Detail

CHEMBL1182611

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Cc1onc(-c2ccccc2)c1-c1ccc(S(=O)(=O)NO)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1182611
Phase Preclinical
Structure Type MOL
InChI Key ONTHNDYCEKOFIC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

330.4
MW (Da)
2.98
ALogP
5
HBA
2
HBD
92.4
PSA (Ų)
0.72
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H14N2O4S
MW 330.37
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.02

Data from ChEMBL 36 via Core Engine