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Compound Detail

CHEMBL5777446

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O=C1NC2(CCCC2)n2c1ccc(Nc1cc(NC(=O)C3CC3)ncn1)c2=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5777446
Phase Preclinical
Structure Type MOL
InChI Key MPKGGPLLAPUWLX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

380.4
MW (Da)
1.70
ALogP
7
HBA
3
HBD
118.0
PSA (Ų)
0.74
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H20N6O3
MW 380.41
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness -0.96

Data from ChEMBL 36 via Core Engine