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Compound Detail

CHEMBL1621514

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Cc1nc(N)nc(N)c1/C=C/C(C)(C)c1ccc(Cl)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1621514
Phase Preclinical
Structure Type MOL
InChI Key XZNLCSHBZVMZOG-CMDGGOBGSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

302.8
MW (Da)
3.59
ALogP
4
HBA
2
HBD
77.8
PSA (Ų)
0.91
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H19ClN4
MW 302.81
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -0.26

Data from ChEMBL 36 via Core Engine