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Compound Detail

CHEMBL4598185

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Cc1c(OCCN(C)C)ccc2c3c(c(=O)oc12)CN(C(=O)c1ccc(C(=O)O)cc1)CC3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4598185
Phase Preclinical
Structure Type MOL
InChI Key VIEIBPBFDGKCSD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

450.5
MW (Da)
2.94
ALogP
6
HBA
1
HBD
100.3
PSA (Ų)
0.58
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H26N2O6
MW 450.49
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -0.75

Data from ChEMBL 36 via Core Engine