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Compound Detail

CHEMBL4292657

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C[C@@H](Nc1nc(N[C@H](C)C2CC2)nc(-c2cccc(CO)c2)n1)C1CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4292657
Phase Preclinical
Structure Type MOL
InChI Key DXDMRKXHWQBBBA-CHWSQXEVSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

353.5
MW (Da)
3.45
ALogP
6
HBA
3
HBD
83.0
PSA (Ų)
0.67
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H27N5O
MW 353.47
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -0.42

Data from ChEMBL 36 via Core Engine