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Compound Detail

CHEMBL1405895

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CC1=NN(c2ccccc2)C(=O)C1N=Nc1ccc(N)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1405895
Phase Preclinical
Structure Type MOL
InChI Key KCOBQGBIGCVBCR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

293.3
MW (Da)
3.14
ALogP
5
HBA
1
HBD
83.4
PSA (Ų)
0.70
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 C16H15N5O
MW 293.33
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -0.98

Data from ChEMBL 36 via Core Engine