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Compound Detail

CHEMBL343287

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CCN(CC)c1ccc(N2CCN(C(=O)C3(C)CCc4c(C)c(O)c(C)c(C)c4O3)CC2)nc1N(CC)CC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL343287
Phase Preclinical
Structure Type MOL
InChI Key XHFCTOFWIDVQQC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

537.8
MW (Da)
4.84
ALogP
7
HBA
1
HBD
72.4
PSA (Ų)
0.52
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C31H47N5O3
MW 537.75
Aromatic Rings 2
Heavy Atoms 39
NP-Likeness -0.37

Data from ChEMBL 36 via Core Engine