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Compound Detail

CHEMBL4299848

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COc1cc(CN(CCCN(Cc2ccc(O)c(OC)c2)Cc2ccc(O)c(OC)c2)Cc2ccc(O)c(OC)c2)ccc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4299848
Phase Preclinical
Structure Type MOL
InChI Key ZZOJNTYQOZBBEH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

618.7
MW (Da)
5.64
ALogP
10
HBA
4
HBD
124.3
PSA (Ų)
0.13
QED
2
Ro5 Violations
16
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C35H42N2O8
MW 618.73
Aromatic Rings 4
Heavy Atoms 45
NP-Likeness -0.21

Data from ChEMBL 36 via Core Engine