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Compound Detail

CHEMBL1195741

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CCc1cc(Nc2cc(=O)n(CCCCN3CCN(c4cc5c(cc4F)c(=O)c(C(=O)O)cn5C(C)(C)C)CC3)c(=O)[nH]2)ccc1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1195741
Phase Preclinical
Structure Type MOL
InChI Key FEMMPNIZRNDXHL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

646.8
MW (Da)
4.66
ALogP
9
HBA
3
HBD
132.7
PSA (Ų)
0.21
QED
1
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C35H43FN6O5
MW 646.76
Aromatic Rings 4
Heavy Atoms 47
NP-Likeness -1.09

Data from ChEMBL 36 via Core Engine