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Compound Detail

CHEMBL4804000

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CC1(C)N=C(N)N=C(N)N1OCC(=O)Nc1ccc(Cl)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4804000
Phase Preclinical
Structure Type MOL
InChI Key NFSDKWLTDMRPDV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

324.8
MW (Da)
0.89
ALogP
7
HBA
3
HBD
118.3
PSA (Ų)
0.76
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H17ClN6O2
MW 324.77
Aromatic Rings 1
Heavy Atoms 22
NP-Likeness -1.02

Data from ChEMBL 36 via Core Engine