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Compound Detail

CHEMBL109911

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CCC(CC)CN1CCN(C(=O)NCCCOc2ccc3[nH]c4nc(O)nc-4cc3c2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL109911
Phase Preclinical
Structure Type MOL
InChI Key JWZFQYXAQWGIJA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

454.6
MW (Da)
3.30
ALogP
6
HBA
3
HBD
106.6
PSA (Ų)
0.43
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H34N6O3
MW 454.58
Aromatic Rings 1
Heavy Atoms 33
NP-Likeness -1.22

Data from ChEMBL 36 via Core Engine