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Compound Detail

CHEMBL1206219

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COc1cccc(NC(=O)c2c(-c3ccc(F)cc3)c(-c3ccc(F)cc3)c(CC[C@@H](O)C[C@@H](O)CC(=O)O)n2C(C)C)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1206219
Phase Preclinical
Structure Type MOL
InChI Key NPPXIWPMCDIBCA-KAYWLYCHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

606.7
MW (Da)
6.46
ALogP
6
HBA
4
HBD
121.0
PSA (Ų)
0.14
QED
2
Ro5 Violations
13
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C34H36F2N2O6
MW 606.67
Aromatic Rings 4
Heavy Atoms 44
NP-Likeness -0.41

Data from ChEMBL 36 via Core Engine