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Compound Detail

CHEMBL1189317

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COC(=O)c1c(-c2cc(OC)c(OC)c(OC)c2)c2cc(OC)ccc2c(=O)n1-c1ccc(N)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1189317
Phase Preclinical
Structure Type MOL
InChI Key BSAJHXJFZNFRLJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

490.5
MW (Da)
4.06
ALogP
9
HBA
1
HBD
111.2
PSA (Ų)
0.31
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H26N2O7
MW 490.51
Aromatic Rings 4
Heavy Atoms 36
NP-Likeness -0.25

Data from ChEMBL 36 via Core Engine