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Compound Detail

CHEMBL2078766

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Cn1cc2c(nc(NC(=O)NC3CCN(C(=O)Nc4ccncc4)CC3)n3nc(-c4ccco4)nc23)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2078766
Phase Preclinical
Structure Type MOL
InChI Key TTZMFTDWOAMKAI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

501.5
MW (Da)
2.48
ALogP
10
HBA
3
HBD
160.4
PSA (Ų)
0.34
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H23N11O3
MW 501.51
Aromatic Rings 5
Heavy Atoms 37
NP-Likeness -2.06

Data from ChEMBL 36 via Core Engine