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Compound Detail

CHEMBL1207742

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CC(C)(C)OC(=O)/C=C/c1c(C(=O)O)[nH]c2cc(Cl)cc(Cl)c12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1207742
Phase Preclinical
Structure Type MOL
InChI Key HZJBNZGLYQVGEL-SNAWJCMRSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

356.2
MW (Da)
4.53
ALogP
3
HBA
2
HBD
79.4
PSA (Ų)
0.63
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 C16H15Cl2NO4
MW 356.20
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.22

Data from ChEMBL 36 via Core Engine