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Compound Detail

CHEMBL3787788

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CCOC(=O)c1cc(C(=O)c2ccccc2O)n2ccc(C(=O)N[C@H]3CN4CCC3CC4)cc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3787788
Phase Preclinical
Structure Type MOL
InChI Key AHASIHRZYTYYPR-FQEVSTJZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

461.5
MW (Da)
2.88
ALogP
7
HBA
2
HBD
100.3
PSA (Ų)
0.43
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H27N3O5
MW 461.52
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -0.56

Data from ChEMBL 36 via Core Engine