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Compound Detail

CHEMBL1178194

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CC(C)(C)OC(=O)c1ncn2c1CN(C(=O)N1CCCC1)c1cc(Cl)ccc1-2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1178194
Phase Preclinical
Structure Type MOL
InChI Key IZDFQLCCPIBHAU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

402.9
MW (Da)
4.02
ALogP
5
HBA
0
HBD
67.7
PSA (Ų)
0.68
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H23ClN4O3
MW 402.88
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness -0.86

Data from ChEMBL 36 via Core Engine