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Compound Detail

CHEMBL1184034

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Cc1cc(-c2ccccc2S(N)(=O)=O)ccc1NC(=O)C1(Cn2cnnn2)CC(c2cccc(C(=N)N)c2)=NO1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1184034
Phase Preclinical
Structure Type MOL
InChI Key PHHWZEWSGHCFRK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

559.6
MW (Da)
1.78
ALogP
10
HBA
4
HBD
204.3
PSA (Ų)
0.18
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H25N9O4S
MW 559.61
Aromatic Rings 4
Heavy Atoms 40
NP-Likeness -1.41

Data from ChEMBL 36 via Core Engine