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Compound Detail

CHEMBL166562

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CN(C)CCNC(=O)c1cccc2[nH]c(-c3ccc(N(C)C)cc3)nc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL166562
Phase Preclinical
Structure Type MOL
InChI Key LKQRXPXGICHDEP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

351.4
MW (Da)
2.59
ALogP
4
HBA
2
HBD
64.3
PSA (Ų)
0.72
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H25N5O
MW 351.45
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.39

Data from ChEMBL 36 via Core Engine