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Compound Detail

CHEMBL4803474

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CC1(C)N=C(N)N=C(N)N1OCCCNc1ccc(Cl)c(Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4803474
Phase Preclinical
Structure Type MOL
InChI Key SJQSWDRRJJVNCY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

359.3
MW (Da)
2.41
ALogP
7
HBA
3
HBD
101.3
PSA (Ų)
0.68
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H20Cl2N6O
MW 359.26
Aromatic Rings 1
Heavy Atoms 23
NP-Likeness -0.79

Data from ChEMBL 36 via Core Engine