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Compound Detail

CHEMBL2079181

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CN1CCN(C(=O)N2CCC(NC(=O)Nc3nc4nn(C)cc4c4nc(-c5ccco5)nn34)CC2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2079181
Phase Preclinical
Structure Type MOL
InChI Key MMPIVZZKIFXAHR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

507.6
MW (Da)
1.22
ALogP
10
HBA
2
HBD
142.0
PSA (Ų)
0.42
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H29N11O3
MW 507.56
Aromatic Rings 4
Heavy Atoms 37
NP-Likeness -1.78

Data from ChEMBL 36 via Core Engine