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Compound Detail

CHEMBL91464

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Cc1ncc(C(=O)O)c(N(CCC(C)C)Cc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL91464
Phase Preclinical
Structure Type MOL
InChI Key VGGNQCASTVNNGE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

457.5
MW (Da)
4.38
ALogP
7
HBA
2
HBD
120.8
PSA (Ų)
0.38
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H27N7O2
MW 457.54
Aromatic Rings 4
Heavy Atoms 34
NP-Likeness -1.00

Data from ChEMBL 36 via Core Engine