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Compound Detail

CHEMBL1194958

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CN(C)CCn1c(=O)c2ccc(NCCN)c3c(=O)c4ccccc4n(c1=O)c23
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1194958
Phase Preclinical
Structure Type MOL
InChI Key HWBYBFMPIYZHII-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

393.4
MW (Da)
0.50
ALogP
8
HBA
2
HBD
101.8
PSA (Ų)
0.37
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 C21H23N5O3
MW 393.45
Aromatic Rings 4
Heavy Atoms 29
NP-Likeness -0.80

Data from ChEMBL 36 via Core Engine