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Compound Detail

CHEMBL1789601

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CCCNS(=O)(=O)c1cc(C(=O)N=C(N)N)ccc1CN1CCN(Cc2ccc(OC)c(OC)c2OC)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1789601
Phase Preclinical
Structure Type MOL
InChI Key CZKRYYUXBDSAKG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

562.7
MW (Da)
1.13
ALogP
8
HBA
3
HBD
161.8
PSA (Ų)
0.25
QED
1
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H38N6O6S
MW 562.69
Aromatic Rings 2
Heavy Atoms 39
NP-Likeness -1.06

Data from ChEMBL 36 via Core Engine