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Compound Detail

CHEMBL4596409

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CN[C@@H]1CCN(c2ccnc(NCC(C)(C)C)n2)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4596409
Phase Preclinical
Structure Type MOL
InChI Key ZZPQCQWVWDUPSI-LLVKDONJSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

263.4
MW (Da)
1.73
ALogP
5
HBA
2
HBD
53.1
PSA (Ų)
0.87
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H25N5
MW 263.39
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness -1.45

Data from ChEMBL 36 via Core Engine